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Benzeneheptadecanoic acid, 4-methoxy-, 3-methoxy-2-(9-methyldecyl)-5-(4-methylpentyl)phenyl ester
SpectraBase Compound ID 8GizoS9PwCc
InChI InChI=1S/C48H80O4/c1-40(2)28-23-19-17-18-21-25-32-45-46(51-6)38-43(31-27-29-41(3)4)39-47(45)52-48(49)33-26-22-16-14-12-10-8-7-9-11-13-15-20-24-30-42-34-36-44(50-5)37-35-42/h34-41H,7-33H2,1-6H3
InChIKey UYVRADBCNJWCTH-UHFFFAOYSA-N
Mol Weight 721.2 g/mol
Molecular Formula C48H80O4
Exact Mass 720.605661 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BqVkp7pbSsv
Name Benzeneheptadecanoic acid, 4-methoxy-, 3-methoxy-2-(9-methyldecyl)-5-(4-methylpentyl)phenyl ester
Alternate Name(s) (3-methoxy-2-(9-methyldecyl)-5-(4-methoxypentyl)phenylester)of 17-(4-methoxyphenyl)heptadecancarboxylic acid 3-Methoxy-2-(9-methyldecyl)-5-(4-methylpentyl)phenyl 17-(4-methoxyphenyl)heptadecanoate 17-(4-methoxyphenyl)heptadecanoic acid [3-methoxy-2-(9-methyldecyl)-5-(4-methylpentyl)phenyl] ester [5-isohexyl-3-methoxy-2-(9-methyldecyl)phenyl] 17-(4-methoxyphenyl)heptadecanoate [3-methoxy-2-(9-methyldecyl)-5-(4-methylpentyl)phenyl] 17-(4-methoxyphenyl)heptadecanoate
CAS Registry Number 69506-06-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H80O4
InChI InChI=1S/C48H80O4/c1-40(2)28-23-19-17-18-21-25-32-45-46(51-6)38-43(31-27-29-41(3)4)39-47(45)52-48(49)33-26-22-16-14-12-10-8-7-9-11-13-15-20-24-30-42-34-36-44(50-5)37-35-42/h34-41H,7-33H2,1-6H3
InChIKey UYVRADBCNJWCTH-UHFFFAOYSA-N
Molecular Weight 721.164 g/mol
SMILES c1(c(c(OC)cc(c1)CCCC(C)C)CCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCCc1ccc(cc1)OC
SPLASH splash10-03k9-0239000000-fa0d8204767c956cda8a
Source of Spectrum K-112-206-0
Wiley ID 1415641