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6-Acetyl-7,8-dihydro-6H-thieno[3,2-e]indole-2-carboxylic acid
SpectraBase Compound ID JpytexCyPm7
InChI InChI=1S/C13H11NO3S/c1-7(15)14-5-4-8-9-6-12(13(16)17)18-11(9)3-2-10(8)14/h2-3,6H,4-5H2,1H3,(H,16,17)
InChIKey JBMRJXUDYXJBDT-UHFFFAOYSA-N
Mol Weight 261.29 g/mol
Molecular Formula C13H11NO3S
Exact Mass 261.045964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IAdUcAHOLqv
Name 6-Acetyl-7,8-dihydro-6H-thieno[3,2-e]indole-2-carboxylic acid
CAS Registry Number 105518-59-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H11NO3S
InChI InChI=1S/C13H11NO3S/c1-7(15)14-5-4-8-9-6-12(13(16)17)18-11(9)3-2-10(8)14/h2-3,6H,4-5H2,1H3,(H,16,17)
InChIKey JBMRJXUDYXJBDT-UHFFFAOYSA-N
Molecular Weight 261.295 g/mol
SMILES OC(c1cc2c3c(N(C(=O)C)CC3)ccc2s1)=O
SPLASH splash10-014i-0290000000-a258c24186c7a4f233d9
Source of Spectrum J-52-26-8
Wiley ID 1264622