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Heptanoic acid, 7-(5-acetylaminomethylthien-2-yl)-
SpectraBase Compound ID 8cXfIcDWXGE
InChI InChI=1S/C14H21NO3S/c1-11(16)15-10-13-9-8-12(19-13)6-4-2-3-5-7-14(17)18/h8-9H,2-7,10H2,1H3,(H,15,16)(H,17,18)
InChIKey BBHDHWKOMZHVHY-UHFFFAOYSA-N
Mol Weight 283.39 g/mol
Molecular Formula C14H21NO3S
Exact Mass 283.124215 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JE6XMzonQbi
Name Heptanoic acid, 7-(5-acetylaminomethylthien-2-yl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21NO3S
InChI InChI=1S/C14H21NO3S/c1-11(16)15-10-13-9-8-12(19-13)6-4-2-3-5-7-14(17)18/h8-9H,2-7,10H2,1H3,(H,15,16)(H,17,18)
InChIKey BBHDHWKOMZHVHY-UHFFFAOYSA-N
Molecular Weight 283.386 g/mol
SMILES OC(CCCCCCc1sc(CNC(=O)C)cc1)=O
SPLASH splash10-03g4-7930000000-d37089d3175c3c028ec8
Synonyms 7-(5-[(Acetylamino)methyl]-2-thienyl)heptanoic acid 7-[5-(acetamidomethyl)-2-thienyl]enanthic acid 7-[5-(acetamidomethyl)-2-thienyl]heptanoic acid 7-[5-(acetamidomethyl)-2-thiophenyl]heptanoic acid 7-[5-(acetamidomethyl)thiophen-2-yl]heptanoic acid
Wiley ID 1439344