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(2R,4R,6R)-trimethylhexacosanoic acid methyl ester
SpectraBase Compound ID BkR6i7lrNrr
InChI InChI=1S/C30H60O2/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27(2)25-28(3)26-29(4)30(31)32-5/h27-29H,6-26H2,1-5H3/t27-,28-,29-/m1/s1
InChIKey OEOVICMOGIAKJO-MPFGFTFXSA-N
Mol Weight 452.8 g/mol
Molecular Formula C30H60O2
Exact Mass 452.459331 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6X5qZtVGOcw
Name (2R,4R,6R)-trimethylhexacosanoic acid methyl ester
Alternate Name(s) Mycocerosic acid methyl ester-C29 Methyl (2R,4R,6R)-2,4,6-trimethylhexacosanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H60O2
InChI InChI=1S/C30H60O2/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27(2)25-28(3)26-29(4)30(31)32-5/h27-29H,6-26H2,1-5H3/t27-,28-,29-/m1/s1
InChIKey OEOVICMOGIAKJO-MPFGFTFXSA-N
Literature Reference DOI 10.1002/rcm.6694
Molecular Weight 452.808 g/mol
SMILES CCCCCCCCCCCCCCCCCCCC[C@](C[C@](C[C@](C(=O)OC)(C)[H])(C)[H])(C)[H]
SPLASH splash10-0udr-9800000000-fe3703e8fc1a947d82e7
Source of Spectrum RCM-27-2377-Fig3(a)
Wiley ID 1820713