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

*Links on SpectraBase are not permalinks.
2-Cyano-3-(1,3-diphenyl-1H-pyrazol-4-yl)-N-dodecylpropenylamide
SpectraBase Compound ID 7zs4TIqcHZi
InChI InChI=1S/C31H38N4O/c1-2-3-4-5-6-7-8-9-10-17-22-33-31(36)27(24-32)23-28-25-35(29-20-15-12-16-21-29)34-30(28)26-18-13-11-14-19-26/h11-16,18-21,23,25H,2-10,17,22H2,1H3,(H,33,36)
InChIKey RAZAWKHQBGPBFD-UHFFFAOYSA-N
Mol Weight 482.7 g/mol
Molecular Formula C31H38N4O
Exact Mass 482.304562 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID HABqgIV88I3
Name 2-Cyano-3-(1,3-diphenyl-1H-pyrazol-4-yl)-N-dodecylpropenylamide
Appearance White crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H38N4O
InChI InChI=1S/C31H38N4O/c1-2-3-4-5-6-7-8-9-10-17-22-33-31(36)27(24-32)23-28-25-35(29-20-15-12-16-21-29)34-30(28)26-18-13-11-14-19-26/h11-16,18-21,23,25H,2-10,17,22H2,1H3,(H,33,36)
InChIKey RAZAWKHQBGPBFD-UHFFFAOYSA-N
Instrument Name Thermo Scientific GCMS ISQ LT
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4168
Molecular Weight 482.672 g/mol
SMILES N(C(C(=Cc1c(-c2ccccc2)n[n](-c2ccccc2)c1)C#N)=O)CCCCCCCCCCCC
SPLASH splash10-01ti-3593700000-9673617eeffa2efd29f5
Source of Spectrum Y-58-299-6
Wiley ID 1879307