| SpectraBase Spectrum ID |
Errk337hMBU |
| Name |
2,2'-bis(2-Carboxyethyl)-3,3'-dichlorobiphenyl |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
366.042564391 u |
| Formula |
C18H16Cl2O4 |
| InChI |
InChI=1S/C18H16Cl2O4/c19-15-5-1-3-11(13(15)7-9-17(21)22)12-4-2-6-16(20)14(12)8-10-18(23)24/h1-6H,7-10H2,(H,21,22)(H,23,24) |
| InChIKey |
BCUVZYLFOBVVHY-UHFFFAOYSA-N |
| Molecular Weight |
367.228 g/mol |
| SMILES |
C=1(C=2C(CCC(=O)O)=C(Cl)C=CC2)C(CCC(=O)O)=C(Cl)C=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931377 |
