| SpectraBase Spectrum ID |
AOVNEUmXTkF |
| Name |
Benzoic acid, 3-chloro-2,5-dimethyl-4,6-bis(phenylmethoxy)- |
| Alternate Name(s) |
2,4-bis(benzyloxy)-5-chloro-3,6-dimethylbenzoic acid
2,4-Dibenzyloxy-5-chloro-3,6-dimethylbenzoic acid |
| CAS Registry Number |
111258-47-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H21ClO4 |
| InChI |
InChI=1S/C23H21ClO4/c1-15-19(23(25)26)21(27-13-17-9-5-3-6-10-17)16(2)22(20(15)24)28-14-18-11-7-4-8-12-18/h3-12H,13-14H2,1-2H3,(H,25,26) |
| InChIKey |
YZAVTQIDUBIGGV-UHFFFAOYSA-N |
| Molecular Weight |
396.870 g/mol |
| SMILES |
OC(c1c(c(C)c(c(c1C)Cl)OCc1ccccc1)OCc1ccccc1)=O |
| SPLASH |
splash10-0006-9000000000-e680a84ad953ecec3db8 |
| Source of Spectrum |
B-40-1586-15 |
| Wiley ID |
1367502 |
