SpectraBase Spectrum ID |
CIKJUxF8L2h |
Name |
6-Methoxy-2-methyl-1-(4-nitrophenyl)-1H-indene |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
281.105193344 u |
Formula |
C17H15NO3 |
InChI |
InChI=1S/C17H15NO3/c1-11-9-13-5-8-15(21-2)10-16(13)17(11)12-3-6-14(7-4-12)18(19)20/h3-10,17H,1-2H3 |
InChIKey |
VVPHBOUTYPEPTO-UHFFFAOYSA-N |
SMILES |
C1=C(C=C2C(=C1)C=C(C)C2C1=CC=C(C=C1)[N+](=O)[O-])OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.908007 |