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1-({1-[(5-bromo-2-thienyl)sulfonyl]-3-piperidinyl}carbonyl)-4-[(4-chlorophenyl)(phenyl)methyl]piperazine
SpectraBase Compound ID EuOJVO1lLAF
InChI InChI=1S/C27H29BrClN3O3S2/c28-24-12-13-25(36-24)37(34,35)32-14-4-7-22(19-32)27(33)31-17-15-30(16-18-31)26(20-5-2-1-3-6-20)21-8-10-23(29)11-9-21/h1-3,5-6,8-13,22,26H,4,7,14-19H2
InChIKey KPUWQDVXZQUAMX-UHFFFAOYSA-N
Mol Weight 623.02 g/mol
Molecular Formula C27H29BrClN3O3S2
Exact Mass 621.052225 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4bBNkswsA9k
Name 1-({1-[(5-bromo-2-thienyl)sulfonyl]-3-piperidinyl}carbonyl)-4-[(4-chlorophenyl)(phenyl)methyl]piperazine
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 621.052224851 u
Formula C27H29BrClN3O3S2
InChI InChI=1S/C27H29BrClN3O3S2/c28-24-12-13-25(36-24)37(34,35)32-14-4-7-22(19-32)27(33)31-17-15-30(16-18-31)26(20-5-2-1-3-6-20)21-8-10-23(29)11-9-21/h1-3,5-6,8-13,22,26H,4,7,14-19H2
InChIKey KPUWQDVXZQUAMX-UHFFFAOYSA-N
Molecular Weight 623.024 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_3025
Solvent DMSO-d6
Source Vendor ID: NMR/12288309