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3-isoquinolinecarboxamide, 1,2,3,4-tetrahydro-2-[(4-methoxyphenyl)sulfonyl]-N-(phenylmethyl)-

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3-isoquinolinecarboxamide, 1,2,3,4-tetrahydro-2-[(4-methoxyphenyl)sulfonyl]-N-(phenylmethyl)-
SpectraBase Compound ID JCadOC3Srzi
InChI InChI=1S/C24H24N2O4S/c1-30-21-11-13-22(14-12-21)31(28,29)26-17-20-10-6-5-9-19(20)15-23(26)24(27)25-16-18-7-3-2-4-8-18/h2-14,23H,15-17H2,1H3,(H,25,27)
InChIKey LSTHYABUMHFFIH-UHFFFAOYSA-N
Mol Weight 436.53 g/mol
Molecular Formula C24H24N2O4S
Exact Mass 436.145678 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E2bWdWxmLEQ
Name 3-isoquinolinecarboxamide, 1,2,3,4-tetrahydro-2-[(4-methoxyphenyl)sulfonyl]-N-(phenylmethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 436.145678431 u
Formula C24H24N2O4S
InChI InChI=1S/C24H24N2O4S/c1-30-21-11-13-22(14-12-21)31(28,29)26-17-20-10-6-5-9-19(20)15-23(26)24(27)25-16-18-7-3-2-4-8-18/h2-14,23H,15-17H2,1H3,(H,25,27)
InChIKey LSTHYABUMHFFIH-UHFFFAOYSA-N
Molecular Weight 436.526 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16684
Solvent DMSO-d6
Source Vendor ID: NMR/11211412; Lab Info: KND; Lab Number: KND-0101053