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Oxirane, 2-(4,8-dimethyl-3,7-nonadienyl)-2-methyl-3-(4,8,12-trimethyl-3,7,11-tridecatrienyl)-, [2.alpha.(E),3.beta.(3E,7E)]-(.+-.)-
SpectraBase Compound ID Ba83HUJ05Rx
InChI InChI=1S/C30H50O/c1-24(2)14-9-16-26(5)18-11-19-27(6)20-12-22-29-30(8,31-29)23-13-21-28(7)17-10-15-25(3)4/h14-15,18,20-21,29H,9-13,16-17,19,22-23H2,1-8H3/b26-18+,27-20+,28-21+/t29-,30+/m1/s1
InChIKey OZBVWSJPTAXJQA-FFUVQHCRSA-N
Mol Weight 426.7 g/mol
Molecular Formula C30H50O
Exact Mass 426.386166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8piCW6PvUM6
Name Oxirane, 2-(4,8-dimethyl-3,7-nonadienyl)-2-methyl-3-(4,8,12-trimethyl-3,7,11-tridecatrienyl)-, [2.alpha.(E),3.beta.(3E,7E)]-(.+-.)-
CAS Registry Number 118245-21-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O
InChI InChI=1S/C30H50O/c1-24(2)14-9-16-26(5)18-11-19-27(6)20-12-22-29-30(8,31-29)23-13-21-28(7)17-10-15-25(3)4/h14-15,18,20-21,29H,9-13,16-17,19,22-23H2,1-8H3/b26-18+,27-20+,28-21+/t29-,30+/m1/s1
InChIKey OZBVWSJPTAXJQA-FFUVQHCRSA-N
Molecular Weight 426.729 g/mol
SMILES [C@@]1(O[C@@]1(CC\C=C\(CC\C=C\(CCC=C(C)C)C)C)[H])(CC\C=C\(CCC=C(C)C)C)C
SPLASH splash10-0a4s-0910000000-e6a45cc53de378fc1802
Source of Spectrum KC-1988-465-11
Synonyms (2S,3R)-2-[(3E)-4,8-dimethyl-3,7-nonadienyl]-2-methyl-3-[(3E,7E)-4,8,12-trimethyl-3,7,11-tridecatrienyl]oxirane (6E,10E,18E)-trans-14,15-Epoxy-2,6,10,15,19,23-Hexamethyl-2,6,10,18,22-tetracosapentaene (6E,10E,18E)-trans-14,15-epoxy-2,6,10,15,19,23-hexamethyltetracosa-2,6,10,18,22-pentane
Wiley ID 1380273