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Butanoic acid, 4-(4,5,6,7-tetrahydro-3-acetyl-4-oxo-2-benzothiophenyl)-
SpectraBase Compound ID JkTMT89t4E4
InChI InChI=1S/C14H16O4S/c1-8(15)13-10(6-3-7-12(17)18)19-11-5-2-4-9(16)14(11)13/h2-7H2,1H3,(H,17,18)
InChIKey MADCEUPSGLHDER-UHFFFAOYSA-N
Mol Weight 280.34 g/mol
Molecular Formula C14H16O4S
Exact Mass 280.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DChXTkpADRW
Name Butanoic acid, 4-(4,5,6,7-tetrahydro-3-acetyl-4-oxo-2-benzothiophenyl)-
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O4S
InChI InChI=1S/C14H16O4S/c1-8(15)13-10(6-3-7-12(17)18)19-11-5-2-4-9(16)14(11)13/h2-7H2,1H3,(H,17,18)
InChIKey MADCEUPSGLHDER-UHFFFAOYSA-N
Molecular Weight 280.338 g/mol
SMILES OC(CCCc1c(c2c(s1)CCCC2=O)C(=O)C)=O
SPLASH splash10-00dl-8790000000-ff0249a05bee482ba6b9
Source of Spectrum AD-0-2532-0
Synonyms 4-(3-acetyl-4-keto-6,7-dihydro-5H-benzothiophen-2-yl)butyric acid 4-(3-Acetyl-4-oxo-4,5,6,7-tetrahydro-1-benzothien-2-yl)butanoic acid 4-(3-acetyl-4-oxo-6,7-dihydro-5H-1-benzothiophen-2-yl)butanoic acid 4-(3-acetyl-4-oxo-6,7-dihydro-5H-benzothiophen-2-yl)butanoic acid 4-(3-Ethanoyl-4-oxidanylidene-6,7-dihydro-5H-1-benzothiophen-2-yl)butanoic acid
Wiley ID 1425881