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4,4,10-Trimethyl-9-[4',8',12-trimethyldodeca-3',7',11',15'-pentaenyl]-8-methylene-perhydronaphthalene
SpectraBase Compound ID 9fmT3dczKbE
InChI InChI=1S/C33H54/c1-9-10-15-26(2)16-11-17-27(3)18-12-19-28(4)20-13-21-30-29(5)22-23-31-32(6,7)24-14-25-33(30,31)8/h9,16,18,20,30-31H,1,5,10-15,17,19,21-25H2,2-4,6-8H3/b26-16+,27-18+,28-20+/t30-,31?,33+/m0/s1
InChIKey CIERDUUXWDQQGW-FLCDEMDPSA-N
Mol Weight 450.8 g/mol
Molecular Formula C33H54
Exact Mass 450.422552 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8CYccaSFLYd
Name 4,4,10-Trimethyl-9-[4',8',12-trimethyldodeca-3',7',11',15'-pentaenyl]-8-methylene-perhydronaphthalene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H54
InChI InChI=1S/C33H54/c1-9-10-15-26(2)16-11-17-27(3)18-12-19-28(4)20-13-21-30-29(5)22-23-31-32(6,7)24-14-25-33(30,31)8/h9,16,18,20,30-31H,1,5,10-15,17,19,21-25H2,2-4,6-8H3/b26-16+,27-18+,28-20+/t30-,31?,33+/m0/s1
InChIKey CIERDUUXWDQQGW-FLCDEMDPSA-N
Molecular Weight 450.795 g/mol
SMILES [C@@]12(C(C(CCC2)(C)C)CCC([C@@]1(CC\C=C\(CC\C=C\(CC\C=C\(CCC=C)C)C)C)[H])=C)C
SPLASH splash10-0002-5910200000-3b6121cec3a6f3013ea4
Source of Spectrum F5-7-1696-22
Wiley ID 1696448