For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

N-[2-Benzyl-3-(p-tolylsulfonyl)butanoyl]piperidine

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

N-[2-Benzyl-3-(p-tolylsulfonyl)butanoyl]piperidine
SpectraBase Compound ID 8Dk4SigD6W2
InChI InChI=1S/C23H29NO3S/c1-18-11-13-21(14-12-18)28(26,27)19(2)22(17-20-9-5-3-6-10-20)23(25)24-15-7-4-8-16-24/h3,5-6,9-14,19,22H,4,7-8,15-17H2,1-2H3
InChIKey KJKMQDSPIMSJBS-UHFFFAOYSA-N
Mol Weight 399.55 g/mol
Molecular Formula C23H29NO3S
Exact Mass 399.186815 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BDoM2cE0geV
Name N-[2-Benzyl-3-(p-tolylsulfonyl)butanoyl]piperidine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 399.186814969 u
Formula C23H29NO3S
InChI InChI=1S/C23H29NO3S/c1-18-11-13-21(14-12-18)28(26,27)19(2)22(17-20-9-5-3-6-10-20)23(25)24-15-7-4-8-16-24/h3,5-6,9-14,19,22H,4,7-8,15-17H2,1-2H3
InChIKey KJKMQDSPIMSJBS-UHFFFAOYSA-N
Molecular Weight 399.549 g/mol
SMILES C(S(C1=CC=C(C=C1)C)(=O)=O)(C(C(N1CCCCC1)=O)CC1=CC=CC=C1)C