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2-({[(5-acetyl-3-thienyl)methyl]amino}carbonyl)benzoic acid
SpectraBase Compound ID 9EOhYCh2BLA
InChI InChI=1S/C15H13NO4S/c1-9(17)13-6-10(8-21-13)7-16-14(18)11-4-2-3-5-12(11)15(19)20/h2-6,8H,7H2,1H3,(H,16,18)(H,19,20)
InChIKey RQTDMWQRQBPEJV-UHFFFAOYSA-N
Mol Weight 303.33 g/mol
Molecular Formula C15H13NO4S
Exact Mass 303.056529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JPQMGwVs8Ya
Name 2-({[(5-acetyl-3-thienyl)methyl]amino}carbonyl)benzoic acid
Alternate Name(s) Phthalic acid,monoamide-,n-(5-acetyltien-3-ylmethyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13NO4S
InChI InChI=1S/C15H13NO4S/c1-9(17)13-6-10(8-21-13)7-16-14(18)11-4-2-3-5-12(11)15(19)20/h2-6,8H,7H2,1H3,(H,16,18)(H,19,20)
InChIKey RQTDMWQRQBPEJV-UHFFFAOYSA-N
Molecular Weight 303.332 g/mol
SMILES N(C(c1c(C(=O)O)cccc1)=O)Cc1cc(sc1)C(=O)C
SPLASH splash10-0w99-2960000000-b6cb1b85893330e60fed
Wiley ID 1450730