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1-Butanone, 1-(5-acetyl-2-thienyl)-3-methyl-
SpectraBase Compound ID H7WRQHg1yQI
InChI InChI=1S/C11H14O2S/c1-7(2)6-9(13)11-5-4-10(14-11)8(3)12/h4-5,7H,6H2,1-3H3
InChIKey IKFYKIYYGSSHEH-UHFFFAOYSA-N
Mol Weight 210.29 g/mol
Molecular Formula C11H14O2S
Exact Mass 210.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3I1CW0zjqS
Name 1-Butanone, 1-(5-acetyl-2-thienyl)-3-methyl-
CAS Registry Number 18282-21-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2S
InChI InChI=1S/C11H14O2S/c1-7(2)6-9(13)11-5-4-10(14-11)8(3)12/h4-5,7H,6H2,1-3H3
InChIKey IKFYKIYYGSSHEH-UHFFFAOYSA-N
Molecular Weight 210.291 g/mol
SMILES CC(C)CC(c1ccc(C(C)=O)s1)=O
SPLASH splash10-0i00-4900000000-dc46cb6d4fdc94461c90
Source of Spectrum T-67-2137-0
Synonyms 1-(5-Acetyl-2-thienyl)-3-methyl-1-butanone 1-(5-acetyl-2-thienyl)-3-methyl-butan-1-one 1-(5-acetyl-2-thiophenyl)-3-methyl-1-butanone 1-(5-acetylthiophen-2-yl)-3-methylbutan-1-one 1-(5-Ethanoylthiophen-2-yl)-3-methyl-butan-1-one
Wiley ID 1208809