For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

benzo[b]thiophene-3-carboxylic acid, 6-(1,1-dimethylethyl)-2-[[(1,3-dimethyl-1H-pyrazol-4-yl)carbonyl]amino]-4,5,6,7-tetrahydro-, methyl ester

View entire compound with spectra: 1 NMR

benzo[b]thiophene-3-carboxylic acid, 6-(1,1-dimethylethyl)-2-[[(1,3-dimethyl-1H-pyrazol-4-yl)carbonyl]amino]-4,5,6,7-tetrahydro-, methyl ester
SpectraBase Compound ID JWMNpFvQDV7
InChI InChI=1S/C20H27N3O3S/c1-11-14(10-23(5)22-11)17(24)21-18-16(19(25)26-6)13-8-7-12(20(2,3)4)9-15(13)27-18/h10,12H,7-9H2,1-6H3,(H,21,24)
InChIKey MIOFBPMIWXJEIP-UHFFFAOYSA-N
Mol Weight 389.51 g/mol
Molecular Formula C20H27N3O3S
Exact Mass 389.177313 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID KJJJGY4oQRK
Name benzo[b]thiophene-3-carboxylic acid, 6-(1,1-dimethylethyl)-2-[[(1,3-dimethyl-1H-pyrazol-4-yl)carbonyl]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 389.177312912 u
Formula C20H27N3O3S
InChI InChI=1S/C20H27N3O3S/c1-11-14(10-23(5)22-11)17(24)21-18-16(19(25)26-6)13-8-7-12(20(2,3)4)9-15(13)27-18/h10,12H,7-9H2,1-6H3,(H,21,24)
InChIKey MIOFBPMIWXJEIP-UHFFFAOYSA-N
Molecular Weight 389.514 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5357
Solvent DMSO-d6
Source Vendor ID: NMR/9245458; Lab Info: PNA; Lab Number: PNA-NA00380