SpectraBase Spectrum ID |
H2tTsEdbFHn |
Name |
Benzeneheptadecanoic acid, 4-methoxy-, 3-methoxy-2-(9-methyldecyl)-5-pentylphenyl ester |
CAS Registry Number |
69506-04-3 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C47H78O4 |
InChI |
InChI=1S/C47H78O4/c1-6-7-24-31-42-38-45(50-5)44(32-27-22-19-18-20-25-29-40(2)3)46(39-42)51-47(48)33-28-23-17-15-13-11-9-8-10-12-14-16-21-26-30-41-34-36-43(49-4)37-35-41/h34-40H,6-33H2,1-5H3 |
InChIKey |
YCPRPZHYSCHATO-UHFFFAOYSA-N |
Molecular Weight |
707.137 g/mol |
SMILES |
c1(c(c(OC)cc(c1)CCCCC)CCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCCc1ccc(cc1)OC |
SPLASH |
splash10-0592-0296000000-659a0ff35a73ac71ecac |
Source of Spectrum |
K-112-206-0 |
Synonyms |
3-Methoxy-2-(9-methyldecyl)-5-pentylphenyl 17-(4-methoxyphenyl)heptadecanoate
Mixture of 2-decyl-5-(4-methylpentyl)- and 2-(9-methyldecyl)-5-pentyl-3-methoxyphenyl esters of 17-(4-methoxyphenyl)-heptadecancarboxylic acid |
Wiley ID |
1415237 |