| SpectraBase Spectrum ID |
6TUb924C0qI |
| Name |
3-Phenoxybenzoic acid |
| Source of Sample |
LGC Cat. #DRE-C16045200; www.lgcstandards.com |
| CAS Registry Number |
3739-38-6 |
| Classification |
Pesticides |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
214.062994179 u |
| Formula |
C13H10O3 |
| InChI |
InChI=1S/C13H10O3/c14-13(15)10-5-4-8-12(9-10)16-11-6-2-1-3-7-11/h1-9H,(H,14,15) |
| InChIKey |
NXTDJHZGHOFSQG-UHFFFAOYSA-N |
| Molecular Weight |
214.220 g/mol |
| Number of Peaks |
178 |
| RI1 |
1898 |
| RI2 |
1852 |
| SMILES |
OC(c1cccc(c1)Oc1ccccc1)=O |
| SPLASH |
splash10-014i-9810000000-3fe3903052b9a3cd4c9b |
| Sample Comments |
RI1: measured on SLB-5ms (Alkanes)
RI2: measured on Equity-1 (Alkanes) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
Benzoic acid, 3-phenoxy- |
| Wiley ID |
LM_PEST_979 |
