| SpectraBase Spectrum ID |
7kbpHKJxhNC |
| Name |
Benzoic acid, 3,5-dihydroxy-2-methyl-4-(methyl-D3)-, methyl ester |
| CAS Registry Number |
89505-62-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H9D3O4 |
| InChI |
InChI=1S/C10H12O4/c1-5-7(10(13)14-3)4-8(11)6(2)9(5)12/h4,11-12H,1-3H3/i2D3 |
| InChIKey |
YTMZTSGRUMCHJS-BMSJAHLVSA-N |
| Molecular Weight |
199.220 g/mol |
| SMILES |
Oc1c(c(cc(c1C)C(=O)OC)O)C([2D])([2D])[2D] |
| SPLASH |
splash10-014s-0900000000-c29cb4943cb5deadd5a8 |
| Source of Spectrum |
KC-1983-2748-0 |
| Synonyms |
Methyl 3,5-dihydroxy-2-methyl-4-[(2)H3]methylbenzoate |
| Wiley ID |
1192739 |
