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Benzenepentadecanoic acid, 4-methoxy-, 2-decyl-3-methoxy-5-pentylphenyl ester
SpectraBase Compound ID I89TTULCZWK
InChI InChI=1S/C44H72O4/c1-5-7-9-10-11-19-22-26-30-41-42(47-4)36-39(29-24-8-6-2)37-43(41)48-44(45)31-27-23-20-17-15-13-12-14-16-18-21-25-28-38-32-34-40(46-3)35-33-38/h32-37H,5-31H2,1-4H3
InChIKey NUVHLXWALTVRMB-UHFFFAOYSA-N
Mol Weight 665.1 g/mol
Molecular Formula C44H72O4
Exact Mass 664.543061 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7sUPZkQcKvI
Name Benzenepentadecanoic acid, 4-methoxy-, 2-decyl-3-methoxy-5-pentylphenyl ester
CAS Registry Number 71142-43-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H72O4
InChI InChI=1S/C44H72O4/c1-5-7-9-10-11-19-22-26-30-41-42(47-4)36-39(29-24-8-6-2)37-43(41)48-44(45)31-27-23-20-17-15-13-12-14-16-18-21-25-28-38-32-34-40(46-3)35-33-38/h32-37H,5-31H2,1-4H3
InChIKey NUVHLXWALTVRMB-UHFFFAOYSA-N
Molecular Weight 665.056 g/mol
SMILES c1(c(c(OC)cc(c1)CCCCC)CCCCCCCCCC)OC(=O)CCCCCCCCCCCCCCc1ccc(cc1)OC
SPLASH splash10-001i-0439001000-99ae5b59e49617397403
Source of Spectrum W5-38202-27334-27334
Synonyms 2-decyl-3-methoxy-5-pentylphenyl 15-(4-methoxyphenyl)pentadecanoate 15-(4-methoxyphenyl)pentadecanoic acid (2-decyl-3-methoxy-5-pentylphenyl) ester (2-decyl-3-methoxy-5-pentylphenyl) 15-(4-methoxyphenyl)pentadecanoate (2-decyl-3-methoxy-5-pentyl-phenyl) 15-(4-methoxyphenyl)pentadecanoate
Wiley ID 1413719