| SpectraBase Spectrum ID |
BmQx64PkscV |
| Name |
1,3-Benzenediol, o-(2-chlorobenzoyl)-o'-(2-methoxybenzoyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
382.060801278 u |
| Formula |
C21H15ClO5 |
| InChI |
InChI=1S/C21H15ClO5/c1-25-19-12-5-3-10-17(19)21(24)27-15-8-6-7-14(13-15)26-20(23)16-9-2-4-11-18(16)22/h2-13H,1H3 |
| InChIKey |
BRBCROSREVJRAZ-UHFFFAOYSA-N |
| Molecular Weight |
382.799 g/mol |
| SMILES |
C1=C(C=CC=C1OC(=O)C1=CC=CC=C1Cl)OC(=O)C1=C(OC)C=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.872911 |
