| SpectraBase Spectrum ID |
FyEVG6MR9Vb |
| Name |
(3-Chlorophenyl)(4-methoxy-3-nitrophenyl)methanone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
291.029835502 u |
| Formula |
C14H10ClNO4 |
| InChI |
InChI=1S/C14H10ClNO4/c1-20-13-6-5-10(8-12(13)16(18)19)14(17)9-3-2-4-11(15)7-9/h2-8H,1H3 |
| InChIKey |
BBKNLCMVMVDRJA-UHFFFAOYSA-N |
| SMILES |
C(=O)(C1=CC(N(=O)=O)=C(C=C1)OC)C1=CC(Cl)=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.899712 |
