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cyclohexanecarboxamide, 1-[[(2-benzoxazolylthio)acetyl](phenylmethyl)amino]-N-(2,6-dimethylphenyl)-
SpectraBase Compound ID ClhhDdaHc4p
InChI InChI=1S/C31H33N3O3S/c1-22-12-11-13-23(2)28(22)33-29(36)31(18-9-4-10-19-31)34(20-24-14-5-3-6-15-24)27(35)21-38-30-32-25-16-7-8-17-26(25)37-30/h3,5-8,11-17H,4,9-10,18-21H2,1-2H3,(H,33,36)
InChIKey DAYXKBBNHSLKIG-UHFFFAOYSA-N
Mol Weight 527.7 g/mol
Molecular Formula C31H33N3O3S
Exact Mass 527.224263 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EzfbzSyjj3h
Name cyclohexanecarboxamide, 1-[[(2-benzoxazolylthio)acetyl](phenylmethyl)amino]-N-(2,6-dimethylphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 527.224263106 u
Formula C31H33N3O3S
InChI InChI=1S/C31H33N3O3S/c1-22-12-11-13-23(2)28(22)33-29(36)31(18-9-4-10-19-31)34(20-24-14-5-3-6-15-24)27(35)21-38-30-32-25-16-7-8-17-26(25)37-30/h3,5-8,11-17H,4,9-10,18-21H2,1-2H3,(H,33,36)
InChIKey DAYXKBBNHSLKIG-UHFFFAOYSA-N
Molecular Weight 527.683 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8769
Solvent DMSO-d6
Source Vendor ID: NMR/10230771; Lab Info: NP; Lab Number: NP-TP00007
Temperature 29.85 °C