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(2R,4R,6R,8R)-tetramethylhexacosanoic acid methyl ester
SpectraBase Compound ID 9bGfO7Sbu7E
InChI InChI=1S/C31H62O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27(2)24-28(3)25-29(4)26-30(5)31(32)33-6/h27-30H,7-26H2,1-6H3/t27-,28-,29-,30-/m1/s1
InChIKey OOKOWPXKJFRGRK-SKKKGAJSSA-N
Mol Weight 466.8 g/mol
Molecular Formula C31H62O2
Exact Mass 466.474981 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EdugauANWJN
Name (2R,4R,6R,8R)-tetramethylhexacosanoic acid methyl ester
Alternate Name(s) Mycocerosic acid methyl ester-C30 Methyl (2R,4R,6R,8R)-2,4,6,8-tetramethylhexacosanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H62O2
InChI InChI=1S/C31H62O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27(2)24-28(3)25-29(4)26-30(5)31(32)33-6/h27-30H,7-26H2,1-6H3/t27-,28-,29-,30-/m1/s1
InChIKey OOKOWPXKJFRGRK-SKKKGAJSSA-N
Literature Reference DOI 10.1002/rcm.6694
Molecular Weight 466.835 g/mol
SMILES CCCCCCCCCCCCCCCCCC[C@](C[C@](C[C@](C[C@](C(=O)OC)(C)[H])(C)[H])(C)[H])(C)[H]
SPLASH splash10-0udr-7911200000-ab327241c52417f75a20
Source of Spectrum RCM-27-2377-Fig3(b)
Wiley ID 1820714