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4,5,6,7-Tetrahydrobenzo[b]thiophene-2-carboxylic acid
SpectraBase Compound ID BVQJeCb65wV
InChI InChI=1S/C9H10O2S/c10-9(11)8-5-6-3-1-2-4-7(6)12-8/h5H,1-4H2,(H,10,11)
InChIKey ROLXOQXKNDKXTA-UHFFFAOYSA-N
Mol Weight 182.24 g/mol
Molecular Formula C9H10O2S
Exact Mass 182.040151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BIcE4Zbe8wJ
Name 4,5,6,7-Tetrahydrobenzo[b]thiophene-2-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O2S
InChI InChI=1S/C9H10O2S/c10-9(11)8-5-6-3-1-2-4-7(6)12-8/h5H,1-4H2,(H,10,11)
InChIKey ROLXOQXKNDKXTA-UHFFFAOYSA-N
Molecular Weight 182.237 g/mol
SMILES OC(c1cc2c(s1)CCCC2)=O
SPLASH splash10-0uei-0900000000-91f56dbb7f698676c465
Source of Spectrum K1-2000-434-18
Synonyms 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid 4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid
Wiley ID 749682