Wikipedia:WikiProject Chemicals/Chembox validation/VerifiedDataSandbox and 6-Acetyl-2,3,4,5-tetrahydropyridine: Difference between pages
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Saving copy of the {{chembox}} taken from revid 468709540 of page 6-Acetyl-2,3,4,5-tetrahydropyridine for the Chem/Drugbox validation project (updated: 'CASNo'). |
removed Category:Ketones; added Category:Acetyl compounds using HotCat |
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{{ambox | text = This page contains a copy of the infobox ({{tl|chembox}}) taken from revid [{{fullurl:6-Acetyl-2,3,4,5-tetrahydropyridine|oldid=468709540}} 468709540] of page [[6-Acetyl-2,3,4,5-tetrahydropyridine]] with values updated to verified values.}} |
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{{Chembox |
{{Chembox |
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| Verifiedfields = changed |
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| verifiedrevid = |
| verifiedrevid = 477225618 |
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| ImageFile = 6-Acetyl-2,3,4,5-tetrahydropyridine.png |
| ImageFile = 6-Acetyl-2,3,4,5-tetrahydropyridine.png |
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| ImageSize = |
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| ImageAlt = |
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| PIN = 1-(3,4,5,6-Tetrahydropyridin-2-yl)ethan-1-one |
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| OtherNames = 2-Acetyl-3,4,5,6-tetrahydropyridine |
| OtherNames = 1-(3,4,5,6-Tetrahydropyridin-2-yl)ethanone<br />2-Acetyl-3,4,5,6-tetrahydropyridine |
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|Section1={{Chembox Identifiers |
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| ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}} |
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| ChemSpiderID = 453844 |
| ChemSpiderID = 453844 |
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| InChI = 1/C7H11NO/c1-6(9)7-4-2-3-5-8-7/h2-5H2,1H3 |
| InChI = 1/C7H11NO/c1-6(9)7-4-2-3-5-8-7/h2-5H2,1H3 |
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| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} |
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} |
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| StdInChIKey = GNZWXNKZMHJXNU-UHFFFAOYSA-N |
| StdInChIKey = GNZWXNKZMHJXNU-UHFFFAOYSA-N |
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| CASNo_Ref = {{cascite| |
| CASNo_Ref = {{cascite|changed|??}} |
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| CASNo = |
| CASNo = 27300-27-2 |
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| CASNo1 = 25343-57-1 |
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| CASNo1_Comment = tautomer |
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| UNII_Ref = {{fdacite|correct|FDA}} |
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| UNII = D3A5PA4S6W |
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| PubChem_Comment = tautomer |
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| ChEBI = 59533 |
| ChEBI = 59533 |
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| ChEBI1 = 59534 |
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| ChEBI1_Comment = tautomer |
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| Beilstein = 1446593, 1446593 |
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| SMILES = O=C(C)C1=NCCCC1}} |
| SMILES = O=C(C)C1=NCCCC1}} |
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|Section2={{Chembox Properties |
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| C=7 | H=11 | N=1 | O=1 |
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| MolarMass = |
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| Solubility = }} |
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|Section3={{Chembox Hazards |
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| MainHazards = |
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| FlashPt = |
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| AutoignitionPt = }} |
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'''6-Acetyl-2,3,4,5-tetrahydropyridine''' is an [[aroma compound]] and [[Flavoring|flavor]] that gives [[baking|baked good]]s such as [[white bread]], [[popcorn]], and [[tortilla]]s their typical smell, together with its structural [[homolog (chemistry)|homolog]] [[2-acetyl-1-pyrroline]]. |
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6-Acetyl-2,3,4,5-tetrahydropyridine and 2-acetyl-1-pyrroline are usually formed by [[Maillard reaction]]s during heating of food. Both compounds have [[Odor detection threshold|odor thresholds]] below 0.06 [[nanogram|ng]]/[[liter|L]].<ref>{{cite journal |
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| author = T. J. Harrison, G. R. Dake |
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| year = 2005 |
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| title = An expeditious, high-yielding construction of the food aroma compounds 6-acetyl-1,2,3,4-tetrahydropyridine and 2-acetyl-1-pyrroline |
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| journal = [[J. Org. Chem.]] |
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| volume = 70 |
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| issue = 26 |
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| pages = 10872–10874 |
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| pmid = 16356012 |
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| doi = 10.1021/jo051940a |
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}}</ref> |
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<ref>{{cite journal|last=De Kimpe|first=Norbert|author2=Stevens, Christian|title=A convenient synthesis of 6-acetyl-1,2,3,4-tetrahydropyridine, the principle bread flavor component|journal=Journal of Organic Chemistry|year=1993|volume=58|issue=10|pages=2904–2906|doi=10.1021/jo00062a042}}</ref> |
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==Structure and properties== |
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6-Acetyl-2,3,4,5-tetrahydropyridine is a [[substitution (chemistry)|substituted]] [[tetrahydropyridine]] and a cyclic [[imine]] as well as a [[ketone]]. The compound exists in a [[chemical equilibrium]] with its [[tautomer]] 6-acetyl-1,2,3,4-tetrahydropyridine that differs only by the position of the [[double bond]] in the tetrahydropyridine ring: |
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{| style="border: 0px; margin: 1em;" |
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|- align="center" |
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| [[Image:6-Acetyl-2,3,4,5-tetrahydropyridine.png|80px|6-Acetyl-2,3,4,5-tetrahydropyridine]] |
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| <math>\rightleftharpoons</math> |
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| [[Image:6-Acetyl-1,2,3,4-tetrahydropyridine.png|80px|6-Acetyl-2,3,4,5-tetrahydropyridine]] |
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|- align="center" |
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| 6-Acetyl-2,3,4,5-tetrahydropyridine |
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| style="padding: 0 1em 0 1em;" | (1 : 2) |
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| 6-Acetyl-1,2,3,4-tetrahydropyridine |
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|} |
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== References == |
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<references/> |
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{{DEFAULTSORT:Acetyl-2, 3, 4, 5-tetrahydropyridine, 6-}} |
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[[Category:Flavors]] |
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[[Category:Acetyl compounds]] |
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[[Category:Imines]] |