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2,5-bis[13C]-5,9,13-Trimethyl-2-[(E)-1',5',9'-trimethyl-4',8'-decadienylidene]-4,8,12-tetrdecatrien-1-ol
SpectraBase Compound ID 1Pn29WXwRnw
InChI InChI=1S/C30H50O/c1-24(2)13-9-15-26(5)17-11-18-28(7)21-22-30(23-31)29(8)20-12-19-27(6)16-10-14-25(3)4/h13-14,17,19,21,31H,9-12,15-16,18,20,22-23H2,1-8H3/b26-17+,27-19+,28-21+,30-29+/i28+1,30+1
InChIKey AUIQRKHZKCQIPW-BDYWZGCLSA-N
Mol Weight 428.7 g/mol
Molecular Formula C2813C2H50O
Exact Mass 428.392876 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IkjzDVay5Xc
Name 2,5-bis[13C]-5,9,13-Trimethyl-2-[(E)-1',5',9'-trimethyl-4',8'-decadienylidene]-4,8,12-tetrdecatrien-1-ol
Comments Original formula: C28[13C]2H50O
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O
InChI InChI=1S/C30H50O/c1-24(2)13-9-15-26(5)17-11-18-28(7)21-22-30(23-31)29(8)20-12-19-27(6)16-10-14-25(3)4/h13-14,17,19,21,31H,9-12,15-16,18,20,22-23H2,1-8H3/b26-17+,27-19+,28-21+,30-29+/i28+1,30+1
InChIKey AUIQRKHZKCQIPW-BDYWZGCLSA-N
Molecular Weight 428.714 g/mol
SMILES OC\[13C](=C\(CC\C=C\(CCC=C(C)C)C)C)C\C=[13C]\(CC\C=C\(CCC=C(C)C)C)C
SPLASH splash10-06ea-9610000000-c7f6498036833492b2d5
Source of Spectrum Y2-25-921-54
Synonyms 2,5-bis(¹³C)-5,9,13-Trimethyl-2-[(E)-1',5',9'-trimethyl-4',8'-decadienylidene]-4,8,12-tetradecatrien-1-ol [2,5-13C2]-(4E,8E)-5,9,13-trimethyl-2-[(E)-1,5,9-trimethyl-4,8-decadienylidene]-4,8,12-tetradecatrien-1-ol
Wiley ID 1547157