| SpectraBase Spectrum ID |
Fp04PyQeNDF |
| Name |
Methanone, (2-amino-3-chlorophenyl)phenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
231.045091645 u |
| Formula |
C13H10ClNO |
| InChI |
InChI=1S/C13H10ClNO/c14-11-8-4-7-10(12(11)15)13(16)9-5-2-1-3-6-9/h1-8H,15H2 |
| InChIKey |
JCPSDGBPFXACKB-UHFFFAOYSA-N |
| Molecular Weight |
231.682 g/mol |
| SMILES |
C=1(C(=O)C=2C=CC=CC2)C(=C(Cl)C=CC1)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.895544 |
