| SpectraBase Spectrum ID |
7Q6HIRmyZyD |
| Name |
Benzoic acid, 3-chloro-2,4,6-trihydroxy-, phenylmethyl ester |
| CAS Registry Number |
131524-46-4 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H11ClO5 |
| InChI |
InChI=1S/C14H11ClO5/c15-12-10(17)6-9(16)11(13(12)18)14(19)20-7-8-4-2-1-3-5-8/h1-6,16-18H,7H2 |
| InChIKey |
FUMNNYQLNGABBJ-UHFFFAOYSA-N |
| Molecular Weight |
294.690 g/mol |
| SMILES |
Oc1c(c(c(c(c1)O)Cl)O)C(OCc1ccccc1)=O |
| SPLASH |
splash10-0006-9000000000-ac2a0375a8bb3e48364a |
| Source of Spectrum |
B-43-1752-5 |
| Synonyms |
Benzyl 3-chloro-2,4,6-trihydroxybenzoate
3-chloro-2,4,6-trihydroxybenzoic acid (phenylmethyl) ester
benzyl 3-chloro-2,4,6-trihydroxy-benzoate
(phenylmethyl) 3-chloranyl-2,4,6-tris(oxidanyl)benzoate |
| Wiley ID |
1296846 |
