SpectraBase Spectrum ID |
LmXBmCVv4xp |
Name |
Benzeneheptadecanoic acid, 3-chloro-4-methoxy-, 3-methoxy-2-(9-methyldecyl)-5-pentylphenyl ester |
CAS Registry Number |
69506-00-9 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C47H77ClO4 |
InChI |
InChI=1S/C47H77ClO4/c1-6-7-24-31-41-37-45(51-5)42(32-27-22-19-18-20-25-29-39(2)3)46(38-41)52-47(49)33-28-23-17-15-13-11-9-8-10-12-14-16-21-26-30-40-34-35-44(50-4)43(48)36-40/h34-39H,6-33H2,1-5H3 |
InChIKey |
YXKCUUPSZODVJE-UHFFFAOYSA-N |
Molecular Weight |
741.582 g/mol |
SMILES |
c1(c(c(OC)cc(c1)CCCCC)CCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCCc1cc(Cl)c(cc1)OC |
SPLASH |
splash10-0002-0139000100-dc72f3f76e543b2c0484 |
Source of Spectrum |
K-112-205-0 |
Synonyms |
3-Methoxy-2-(9-methyldecyl)-5-pentylphenyl 17-(3-chloro-4-methoxyphenyl)heptadecanoate
Mixture of 2-isoundecyl-5-pentyl- and 2-decyl-5-isohexyl-3-meo-phenyl17-(3-cl-4-meo-phenyl)heptadecancarboxylates |
Wiley ID |
1416114 |