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4H-1,2,4-triazole, 3-[[2-nitro-4-(1-pyrrolidinylcarbonyl)phenyl]thio]-4-phenyl-5-(phenylmethyl)-
SpectraBase Compound ID JsJesMBlgbr
InChI InChI=1S/C26H23N5O3S/c32-25(29-15-7-8-16-29)20-13-14-23(22(18-20)31(33)34)35-26-28-27-24(17-19-9-3-1-4-10-19)30(26)21-11-5-2-6-12-21/h1-6,9-14,18H,7-8,15-17H2
InChIKey RFGAHLOPQGBNGD-UHFFFAOYSA-N
Mol Weight 485.56 g/mol
Molecular Formula C26H23N5O3S
Exact Mass 485.152161 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DbiJPv49iGk
Name 4H-1,2,4-triazole, 3-[[2-nitro-4-(1-pyrrolidinylcarbonyl)phenyl]thio]-4-phenyl-5-(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 485.152160792 u
Formula C26H23N5O3S
InChI InChI=1S/C26H23N5O3S/c32-25(29-15-7-8-16-29)20-13-14-23(22(18-20)31(33)34)35-26-28-27-24(17-19-9-3-1-4-10-19)30(26)21-11-5-2-6-12-21/h1-6,9-14,18H,7-8,15-17H2
InChIKey RFGAHLOPQGBNGD-UHFFFAOYSA-N
Molecular Weight 485.562 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7197
Solvent DMSO-d6
Source Vendor ID: NMR/10222389; Lab Info: LP; Lab Number: LP-2100207