| SpectraBase Spectrum ID |
HTGbPLynK3j |
| Name |
Benzoic acid, 3-chloro-2,5-dimethyl-4,6-bis(phenylmethoxy)-, ethyl ester |
| Alternate Name(s) |
ethyl 2,4-bis(benzyloxy)-5-chloro-3,6-dimethylbenzoate
Ethyl 2,4-dibenzyloxy-5-chloro-3,6-dimethylbenzoate |
| CAS Registry Number |
111258-46-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H25ClO4 |
| InChI |
InChI=1S/C25H25ClO4/c1-4-28-25(27)21-17(2)22(26)24(30-16-20-13-9-6-10-14-20)18(3)23(21)29-15-19-11-7-5-8-12-19/h5-14H,4,15-16H2,1-3H3 |
| InChIKey |
WKINBVBVJXBVJR-UHFFFAOYSA-N |
| Molecular Weight |
424.924 g/mol |
| SMILES |
c1(c(c(C)c(c(c1C)Cl)OCc1ccccc1)OCc1ccccc1)C(=O)OCC |
| SPLASH |
splash10-0006-9000000000-c15a21ca80521107a412 |
| Source of Spectrum |
B-40-1586-14 |
| Wiley ID |
1379346 |
