SpectraBase Compound ID | 9fmT3dczKbE |
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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 |
SpectraBase Spectrum ID | 8CYccaSFLYd |
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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 |