Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-11-19 04:50:12 UTC
Update Date2024-09-29 11:40:39 UTC
Metabolite IDMMDBc0033475
Metabolite Identification
Common Name2-acetyl-2-thiazoline
Description2-Acetyl-4,5-dihydrothiazole belongs to the class of organic compounds known as thiazolines. These are heterocyclic compounds containing a five-member unsaturated aliphatic ring with one nitrogen atom, one sulfur atom, three carbon atoms. 2-Acetyl-4,5-dihydrothiazole is a bread, chip, and corn tasting compound. 2-Acetyl-4,5-dihydrothiazole has been detected, but not quantified in, alcoholic beverages and corns (Zea mays). This could make 2-acetyl-4,5-dihydrothiazole a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on 2-Acetyl-4,5-dihydrothiazole.
Structure
Synonyms
ValueSource
1-(4,5-dihydro-1,3-Thiazol-2-yl)ethanoneHMDB
1-(4,5-dihydro-2-Thiazolyl)-ethanoneHMDB
1-(4,5-dihydro-2-Thiazolyl)ethanone, 9ciHMDB
2-Acetyl-2-thiazolineHMDB
2-AcetylthiazolineHMDB
2-Thiazoline, 2-acetylHMDB
AcetylthiazolineHMDB
FEMA 3817HMDB
Methyl 2-thiazolin-2-yl ketone, 8ciHMDB
Molecular FormulaC5H7NOS
Average Mass129.18
Monoisotopic Mass129.024834541
IUPAC Name1-(4,5-dihydro-1,3-thiazol-2-yl)ethan-1-one
Traditional Name1-(4,5-dihydro-1,3-thiazol-2-yl)ethanone
CAS Registry Number29926-41-8
SMILES
CC(=O)C1=NCCS1
InChI Identifier
InChI=1S/C5H7NOS/c1-4(7)5-6-2-3-8-5/h2-3H2,1H3
InChI KeyFZOZFDAMVVEZSJ-UHFFFAOYSA-N