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6,8,11-Trimethyldodecanoic Acid (2E)-3-Methylhexadec-2-enyl Ester
SpectraBase Compound ID EhHOSSNRTlh
InChI InChI=1S/C32H62O2/c1-7-8-9-10-11-12-13-14-15-16-17-20-29(4)25-26-34-32(33)22-19-18-21-30(5)27-31(6)24-23-28(2)3/h25,28,30-31H,7-24,26-27H2,1-6H3/b29-25+
InChIKey QQAKLYHMDALJCZ-XLVZBRSZSA-N
Mol Weight 478.8 g/mol
Molecular Formula C32H62O2
Exact Mass 478.474981 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CseL5F5P9Wm
Name 6,8,11-Trimethyldodecanoic Acid (2E)-3-Methylhexadec-2-enyl Ester
Alternate Name(s) Balansenate I (E)-3-methylhexadec-2-en-1-yl 6,8,11-trimethyldodecanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H62O2
InChI InChI=1S/C32H62O2/c1-7-8-9-10-11-12-13-14-15-16-17-20-29(4)25-26-34-32(33)22-19-18-21-30(5)27-31(6)24-23-28(2)3/h25,28,30-31H,7-24,26-27H2,1-6H3/b29-25+
InChIKey QQAKLYHMDALJCZ-XLVZBRSZSA-N
Molecular Weight 478.846 g/mol
SMILES C(CCCCC(CC(CCC(C)C)C)C)(=O)OC\C=C\(CCCCCCCCCCCCC)C
SPLASH splash10-00di-0920000000-0eebe4107631bc924522
Source of Spectrum H-86-2456-1
Wiley ID 1785370