SpectraBase Spectrum ID |
3GRqnW9vg61 |
Name |
2-(4-Methyl-2-methylamino-5-nitro phenyl) indene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
280.121177761 u |
Formula |
C17H16N2O2 |
InChI |
InChI=1S/C17H16N2O2/c1-11-7-16(18-2)15(10-17(11)19(20)21)14-8-12-5-3-4-6-13(12)9-14/h3-8,10,18H,9H2,1-2H3 |
InChIKey |
PMLXMKSTVOKIRF-UHFFFAOYSA-N |
SMILES |
C1(C=2C=C(N(=O)=O)C(=CC2NC)C)=CC2=CC=CC=C2C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964048 |