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Squalene-1,24-diol

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Squalene-1,24-diol
SpectraBase Compound ID 6M4Aw0M57Bz
InChI InChI=1S/C30H50O2/c1-25(15-9-17-27(3)19-11-21-29(5)23-31)13-7-8-14-26(2)16-10-18-28(4)20-12-22-30(6)24-32/h13-14,17-18,21-22,31-32H,7-12,15-16,19-20,23-24H2,1-6H3/b25-13+,26-14+,27-17-,28-18+,29-21+,30-22+
InChIKey RVCMXVWYTHDZLU-PTSJZBNESA-N
Mol Weight 442.7 g/mol
Molecular Formula C30H50O2
Exact Mass 442.381081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DySdMXTsqAn
Name Squalene-1,24-diol
Alternate Name(s) (2E,6Z,10E,14E,18E,22E)-2,6,10,15,19,23-hexamethyl-2,6,10,14,18,22-tetracosahexaene-1,24-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O2
InChI InChI=1S/C30H50O2/c1-25(15-9-17-27(3)19-11-21-29(5)23-31)13-7-8-14-26(2)16-10-18-28(4)20-12-22-30(6)24-32/h13-14,17-18,21-22,31-32H,7-12,15-16,19-20,23-24H2,1-6H3/b25-13+,26-14+,27-17-,28-18+,29-21+,30-22+
InChIKey RVCMXVWYTHDZLU-PTSJZBNESA-N
Molecular Weight 442.728 g/mol
SMILES OC\C(=C\CC\C(=C\CC\C(=C\CC\C=C\(CC\C=C/(CC\C=C\(CO)C)C)C)C)C)C
SPLASH splash10-0a5a-9000000000-9856968383085e994eec
Source of Spectrum AT-38-386-10
Wiley ID 853762