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3-thiophenecarboxylic acid, 5-[[[4-(ethoxycarbonyl)phenyl]amino]carbonyl]-4-methyl-2-[(1-oxo-3-phenylpropyl)amino]-
SpectraBase Compound ID Df4onrYO0X7
InChI InChI=1S/C27H28N2O6S/c1-4-34-26(32)19-12-14-20(15-13-19)28-24(31)23-17(3)22(27(33)35-5-2)25(36-23)29-21(30)16-11-18-9-7-6-8-10-18/h6-10,12-15H,4-5,11,16H2,1-3H3,(H,28,31)(H,29,30)
InChIKey DJXXDCKQUJKYJU-UHFFFAOYSA-N
Mol Weight 508.59 g/mol
Molecular Formula C27H28N2O6S
Exact Mass 508.166808 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LZFPhOe7REU
Name 3-thiophenecarboxylic acid, 5-[[[4-(ethoxycarbonyl)phenyl]amino]carbonyl]-4-methyl-2-[(1-oxo-3-phenylpropyl)amino]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 508.166807798 u
Formula C27H28N2O6S
InChI InChI=1S/C27H28N2O6S/c1-4-34-26(32)19-12-14-20(15-13-19)28-24(31)23-17(3)22(27(33)35-5-2)25(36-23)29-21(30)16-11-18-9-7-6-8-10-18/h6-10,12-15H,4-5,11,16H2,1-3H3,(H,28,31)(H,29,30)
InChIKey DJXXDCKQUJKYJU-UHFFFAOYSA-N
Molecular Weight 508.589 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8039
Solvent DMSO-d6
Source Vendor ID: NMR/9243838; Lab Info: SAS; Lab Number: SAS-TST0947
Temperature 29.85 °C