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Ethyl 2-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
SpectraBase Compound ID CdA3IJTVaDR
InChI InChI=1S/C18H19NO3S/c1-2-22-18(21)15-13-10-6-7-11-14(13)23-17(15)19-16(20)12-8-4-3-5-9-12/h3-5,8-9H,2,6-7,10-11H2,1H3,(H,19,20)
InChIKey NXQQGHWARSPUAH-UHFFFAOYSA-N
Mol Weight 329.41 g/mol
Molecular Formula C18H19NO3S
Exact Mass 329.108565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDX2RuTT3qh
Name Ethyl 2-(benzoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
CAS Registry Number 52580-57-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19NO3S
InChI InChI=1S/C18H19NO3S/c1-2-22-18(21)15-13-10-6-7-11-14(13)23-17(15)19-16(20)12-8-4-3-5-9-12/h3-5,8-9H,2,6-7,10-11H2,1H3,(H,19,20)
InChIKey NXQQGHWARSPUAH-UHFFFAOYSA-N
Molecular Weight 329.414 g/mol
SMILES N(c1c(c2CCCCc2s1)C(=O)OCC)C(=O)c1ccccc1
SPLASH splash10-0a6r-9812000000-d0984289f9bee90c154f
Synonyms 2-Benzamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester 2-Benzamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Ethyl 2-benzamido-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Ethyl 2-benzamido-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate Ethyl 2-benzamido-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
Wiley ID 1468224