SpectraBase Spectrum ID |
BToa1NiZvRy |
Name |
Pentanal, 2-[bis(phenylmethyl)amino]-4-methyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
295.193614428 u |
Formula |
C20H25NO |
InChI |
InChI=1S/C20H25NO/c1-17(2)13-20(16-22)21(14-18-9-5-3-6-10-18)15-19-11-7-4-8-12-19/h3-12,16-17,20H,13-15H2,1-2H3 |
InChIKey |
MTCXPHZCBACKKY-UHFFFAOYSA-N |
SMILES |
C(=O)C(N(CC1=CC=CC=C1)CC1=CC=CC=C1)CC(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.896356 |