| SpectraBase Spectrum ID |
nfZRsjy6Dl |
| Name |
Benzoic acid, 3-chloro-2-hydroxy-4-methoxy-6-pentyl-, 3-hydroxy-5-pentyl-4-[(phenylmethoxy)carbonyl]phenyl ester |
| CAS Registry Number |
120092-00-4 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C32H37ClO7 |
| InChI |
InChI=1S/C32H37ClO7/c1-4-6-9-15-22-17-24(19-25(34)27(22)31(36)39-20-21-13-11-8-12-14-21)40-32(37)28-23(16-10-7-5-2)18-26(38-3)29(33)30(28)35/h8,11-14,17-19,34-35H,4-7,9-10,15-16,20H2,1-3H3 |
| InChIKey |
DPHOURKQEZHFSL-UHFFFAOYSA-N |
| Molecular Weight |
569.094 g/mol |
| SMILES |
Oc1cc(OC(c2c(c(c(cc2CCCCC)OC)Cl)O)=O)cc(c1C(OCc1ccccc1)=O)CCCCC |
| SPLASH |
splash10-0006-9000000000-cc2d46aa98fc41604fc4 |
| Source of Spectrum |
B-41-1794-6 |
| Synonyms |
4-[(benzyloxy)carbonyl]-3-hydroxy-5-pentylphenyl 3-chloro-2-hydroxy-4-methoxy-6-pentylbenzoate
Benzyl 3-chloroperlatolate
Benzyl 4-(3'-chloro-2'-hydroxy-4'-methoxy-6'-pentylbenzoyloxy)-2-hydroxy-6-pentylbenzoate |
| Wiley ID |
1407522 |
![Benzoic acid, 3-chloro-2-hydroxy-4-methoxy-6-pentyl-, 3-hydroxy-5-pentyl-4-[(phenylmethoxy)carbonyl]phenyl ester](/api/spectrum/nfZRsjy6Dl/structure.png?h=300&w=458 "Benzoic acid, 3-chloro-2-hydroxy-4-methoxy-6-pentyl-, 3-hydroxy-5-pentyl-4-[(phenylmethoxy)carbonyl]phenyl ester")
