| SpectraBase Spectrum ID |
IU3qrmBzMwv |
| Name |
Isopropyl [(p-nitrophenyl)phenylmethyl] amine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
270.136827826 u |
| Formula |
C16H18N2O2 |
| InChI |
InChI=1S/C16H18N2O2/c1-12(2)17-16(13-6-4-3-5-7-13)14-8-10-15(11-9-14)18(19)20/h3-12,16-17H,1-2H3 |
| InChIKey |
SZDSEJYELMHGCK-UHFFFAOYSA-N |
| SMILES |
C1(N(=O)=O)=CC=C(C(NC(C)C)C=2C=CC=CC2)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.94121 |