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

*Links on SpectraBase are not permalinks.

2-(4-Acetylphenyl)-2-(phenethylamino)acetonitrile

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

2-(4-Acetylphenyl)-2-(phenethylamino)acetonitrile
SpectraBase Compound ID 3ujMHNKlBGZ
InChI InChI=1S/C18H18N2O/c1-14(21)16-7-9-17(10-8-16)18(13-19)20-12-11-15-5-3-2-4-6-15/h2-10,18,20H,11-12H2,1H3
InChIKey LGNSTRPETHBPBR-UHFFFAOYSA-N
Mol Weight 278.35 g/mol
Molecular Formula C18H18N2O
Exact Mass 278.141913 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID 1ZOPK5ZQJoF
Name 2-(4-Acetylphenyl)-2-(phenethylamino)acetonitrile
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 278.141913207 u
Formula C18H18N2O
InChI InChI=1S/C18H18N2O/c1-14(21)16-7-9-17(10-8-16)18(13-19)20-12-11-15-5-3-2-4-6-15/h2-10,18,20H,11-12H2,1H3
InChIKey LGNSTRPETHBPBR-UHFFFAOYSA-N
Molecular Weight 278.355 g/mol
SMILES C(#N)C(C=1C=CC(=CC1)C(=O)C)NCCC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.892843