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benzo[b]thiophene-3-carboxylic acid, 2-[(cyclohexylcarbonyl)amino]-4,5,6,7-tetrahydro-, methyl ester
SpectraBase Compound ID HaglMqWFmzh
InChI InChI=1S/C17H23NO3S/c1-21-17(20)14-12-9-5-6-10-13(12)22-16(14)18-15(19)11-7-3-2-4-8-11/h11H,2-10H2,1H3,(H,18,19)
InChIKey ISQIKWYWHDOCPJ-UHFFFAOYSA-N
Mol Weight 321.44 g/mol
Molecular Formula C17H23NO3S
Exact Mass 321.139865 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID J0X0f20iXf2
Name benzo[b]thiophene-3-carboxylic acid, 2-[(cyclohexylcarbonyl)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 321.139864776 u
Formula C17H23NO3S
InChI InChI=1S/C17H23NO3S/c1-21-17(20)14-12-9-5-6-10-13(12)22-16(14)18-15(19)11-7-3-2-4-8-11/h11H,2-10H2,1H3,(H,18,19)
InChIKey ISQIKWYWHDOCPJ-UHFFFAOYSA-N
Molecular Weight 321.435 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13562
Solvent DMSO-d6
Source Vendor ID: ZI/10022665; Lab Info: PNA; Lab Number: PNA-1991210