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Gammacerane
[CAS# 559-65-9]

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Identification
Name Gammacerane
Synonyms CHEBI:36473
Molecular Structure CAS#: 559-65-9, Gammacerane
Molecular Formula C30H52
Molecular Weight 412.73
CAS Registry Number 559-65-9
SMILES [C@H]45[C@]([C@@H]3[C@@]([C@]1([C@@H]([C@]2(C)[C@@H](CC1)C(C)(C)CCC2)CC3)C)(C)CC4)(C)CCCC5(C)C
InChI 1S/C30H52/c1-25(2)15-9-17-27(5)21(25)13-19-29(7)23(27)11-12-24-28(6)18-10-16-26(3,4)22(28)14-20-30(24,29)8/h21-24H,9-20H2,1-8H3/t21-,22-,23+,24+,27-,28-,29+,30+/m0/s1
InChIKey QDUDLLAGYKHBNK-QPYQYMOUSA-N
Properties
Density 0.917g/cm3 (Cal.)
Boiling point 454.875°C at 760 mmHg (Cal.)
Flash point 220.805°C (Cal.)
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