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3-Acetamido-1-benzothiophene-2-carboxylic acid
SpectraBase Compound ID F7XlPmCeZJX
InChI InChI=1S/C11H9NO3S/c1-6(13)12-9-7-4-2-3-5-8(7)16-10(9)11(14)15/h2-5H,1H3,(H,12,13)(H,14,15)
InChIKey BYTVGSRHXPULKA-UHFFFAOYSA-N
Mol Weight 235.26 g/mol
Molecular Formula C11H9NO3S
Exact Mass 235.030314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5S7dX4REeC7
Name 3-Acetamido-1-benzothiophene-2-carboxylic acid
Alternate Name(s) 3-Acetamidobenzothiophene-2-carboxylic acid
CAS Registry Number 105689-30-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9NO3S
InChI InChI=1S/C11H9NO3S/c1-6(13)12-9-7-4-2-3-5-8(7)16-10(9)11(14)15/h2-5H,1H3,(H,12,13)(H,14,15)
InChIKey BYTVGSRHXPULKA-UHFFFAOYSA-N
Molecular Weight 235.257 g/mol
SMILES N(c1c(C(=O)O)sc2ccccc12)C(=O)C
SPLASH splash10-0006-9410000000-020f2dc5ce1af50eb908
Source of Spectrum Y-22-1501-23
Wiley ID 1236907