| SpectraBase Spectrum ID |
Abb23P8uEzt |
| Name |
2'-Methyl-4-nitro-1, 1'-biphenyl |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
213.078978596 u |
| Formula |
C13H11NO2 |
| InChI |
InChI=1S/C13H11NO2/c1-10-4-2-3-5-13(10)11-6-8-12(9-7-11)14(15)16/h2-9H,1H3 |
| InChIKey |
CVZLYJUYMKUYCZ-UHFFFAOYSA-N |
| Molecular Weight |
213.236 g/mol |
| SMILES |
C=1C=C(C=CC1[N+](=O)[O-])C=1C(=CC=CC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.919998 |
