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1-[1'-(4-tert-butylbenzenesulfonyl)-[1,4'-bipiperidin]-4'-yl]ethan-1-one
SpectraBase Compound ID KZOi7EqWgei
InChI InChI=1S/C21H33N3O3S/c1-20(2,3)17-7-9-18(10-8-17)28(26,27)24-15-11-21(12-16-24,19(22)25)23-13-5-4-6-14-23/h7-10H,4-6,11-16H2,1-3H3,(H2,22,25)
InChIKey LOSFPSBLBSHVQY-UHFFFAOYSA-N
Mol Weight 407.6 g/mol
Molecular Formula C21H33N3O3S
Exact Mass 407.224263 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KFBreoIXNRq
Name 1-[1'-(4-tert-butylbenzenesulfonyl)-[1,4'-bipiperidin]-4'-yl]ethan-1-one
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 407.224263106 u
Formula C21H33N3O3S
InChI InChI=1S/C21H33N3O3S/c1-20(2,3)17-7-9-18(10-8-17)28(26,27)24-15-11-21(12-16-24,19(22)25)23-13-5-4-6-14-23/h7-10H,4-6,11-16H2,1-3H3,(H2,22,25)
InChIKey LOSFPSBLBSHVQY-UHFFFAOYSA-N
Molecular Weight 407.573 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_8307
Solvent DMSO-d6
Source Vendor ID: NMR/13309221