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2,3-Dihydro-1-benzothiophene-3-carboxylic acid methyl ester
SpectraBase Compound ID IYJE2ofPrmw
InChI InChI=1S/C10H10O2S/c1-12-10(11)8-6-13-9-5-3-2-4-7(8)9/h2-5,8H,6H2,1H3
InChIKey WQSWAMIVBYEOJS-UHFFFAOYSA-N
Mol Weight 194.25 g/mol
Molecular Formula C10H10O2S
Exact Mass 194.040151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ogW07qPVnB
Name 2,3-Dihydro-1-benzothiophene-3-carboxylic acid methyl ester
CAS Registry Number 39891-63-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10O2S
InChI InChI=1S/C10H10O2S/c1-12-10(11)8-6-13-9-5-3-2-4-7(8)9/h2-5,8H,6H2,1H3
InChIKey WQSWAMIVBYEOJS-UHFFFAOYSA-N
Molecular Weight 194.248 g/mol
SMILES c1c2c(ccc1)C(CS2)C(=O)OC
SPLASH splash10-000l-9600000000-7cfbcb767cf9dd08d173
Synonyms 2,3-Dihydrobenzothiophene-3-carboxylic acid methyl ester 2,3-Dihydrobenzo[b]thiophene-3-carboxylic acid, methyl ester Methyl 2,3-dihydro-1-benzothiophene-3-carboxylate Methyl 2,3-dihydrobenzothiophene-3-carboxylate
Wiley ID 1480540