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

*Links on SpectraBase are not permalinks.

Butanenitrile, 2,2-diphenyl-4-(4-phenyl-1-piperazinyl)-

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

Butanenitrile, 2,2-diphenyl-4-(4-phenyl-1-piperazinyl)-
SpectraBase Compound ID JO2Uuma3H7v
InChI InChI=1S/C26H27N3/c27-22-26(23-10-4-1-5-11-23,24-12-6-2-7-13-24)16-17-28-18-20-29(21-19-28)25-14-8-3-9-15-25/h1-15H,16-21H2
InChIKey VIFMNVDJPVBVHB-UHFFFAOYSA-N
Mol Weight 381.52 g/mol
Molecular Formula C26H27N3
Exact Mass 381.220498 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 LMh3Mue8qkD
Name Butanenitrile, 2,2-diphenyl-4-(4-phenyl-1-piperazinyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 381.220497881 u
Formula C26H27N3
InChI InChI=1S/C26H27N3/c27-22-26(23-10-4-1-5-11-23,24-12-6-2-7-13-24)16-17-28-18-20-29(21-19-28)25-14-8-3-9-15-25/h1-15H,16-21H2
InChIKey VIFMNVDJPVBVHB-UHFFFAOYSA-N
Molecular Weight 381.523 g/mol
SMILES C(C#N)(CCN1CCN(CC1)C1=CC=CC=C1)(C=1C=CC=CC1)C=1C=CC=CC1