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Squalene
SpectraBase Compound ID GNEyjK9zo2k
InChI InChI=1S/C30H50/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h15-18,23-24H,9-14,19-22H2,1-8H3/b27-17+,28-18+,29-23-,30-24+
InChIKey YYGNTYWPHWGJRM-FLHYQJCXSA-N
Mol Weight 410.7 g/mol
Molecular Formula C30H50
Exact Mass 410.391252 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9bkyyhyJWyl
Name squalene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50
InChI InChI=1S/C30H50/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h15-18,23-24H,9-14,19-22H2,1-8H3/b27-17+,28-18+,29-23-,30-24+
InChIKey YYGNTYWPHWGJRM-FLHYQJCXSA-N
Literature Reference DOI 10.1002/pca.981
Molecular Weight 410.730 g/mol
SMILES CC(C)=CCC\C(C)=C\CC\C(C)=C\CC\C=C/(C)CC\C=C/(CCC=C(C)C)C
SPLASH splash10-007t-6910000000-d6385bb1934ee81bd913
Source of Spectrum PA-18-293-10
Synonyms (6Z,10E,14E,18E)-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaene
Wiley ID 1789524