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benzo[b]thiophene-3-carboxylic acid, 2-[(3-chlorobenzoyl)amino]-4,5,6,7-tetrahydro-, methyl ester
SpectraBase Compound ID HnLafIxbYen
InChI InChI=1S/C17H16ClNO3S/c1-22-17(21)14-12-7-2-3-8-13(12)23-16(14)19-15(20)10-5-4-6-11(18)9-10/h4-6,9H,2-3,7-8H2,1H3,(H,19,20)
InChIKey SRHOZZVOGMCUTA-UHFFFAOYSA-N
Mol Weight 349.83 g/mol
Molecular Formula C17H16ClNO3S
Exact Mass 349.053942 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6fHtenkaq8z
Name benzo[b]thiophene-3-carboxylic acid, 2-[(3-chlorobenzoyl)amino]-4,5,6,7-tetrahydro-, methyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 349.053942250 u
Formula C17H16ClNO3S
InChI InChI=1S/C17H16ClNO3S/c1-22-17(21)14-12-7-2-3-8-13(12)23-16(14)19-15(20)10-5-4-6-11(18)9-10/h4-6,9H,2-3,7-8H2,1H3,(H,19,20)
InChIKey SRHOZZVOGMCUTA-UHFFFAOYSA-N
Molecular Weight 349.832 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12531
Solvent DMSO-d6
Source Vendor ID: ZI/10023964; Lab Info: PNA; Lab Number: PNA-1991269