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Spheroidene
[CAS# 13836-61-8]

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CAS#: 13836-61-8
Product: Spheroidene
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Identification
Name Spheroidene
Synonyms (6E,10E,12E,14E,16E,18E,20E,22E,24E,26E,28E)-31-Methoxy-2,6,10,14,19,23,27,31-Octamethyldotriaconta-2,6,10,12,14,16,18,20,22,24,26,28-Dodecaene; 31-Methoxy-2,6,10,14,19,23,27,31-Octamethyl-Dotriaconta-2,6,10,12,14,16,18,20,22,24,26,28-Dodecaene; (6E,10E,12E,14E,16E,18E,20E,22E,24E,26E,28E)-31-Methoxy-2,6,10,14,19,23,27,31-Octamethyl-Dotriaconta-2,6,10,12,14,16,18,20,22,24,26,28-Dodecaene
Molecular Structure CAS#: 13836-61-8, Spheroidene
Molecular Formula C41H60O
Molecular Weight 568.92
CAS Registry Number 13836-61-8
SMILES C(/C=C(/CCC=C(C)C)C)C\C(=C\C=C\C(=C\C=C\C=C(\C=C\C=C(\C=C\C=C(\C=C\CC(OC)(C)C)C)C)C)C)C
InChI 1S/C41H60O/c1-34(2)20-14-23-37(5)26-17-29-38(6)27-15-24-35(3)21-12-13-22-36(4)25-16-28-39(7)30-18-31-40(8)32-19-33-41(9,10)42-11/h12-13,15-16,18-22,24-28,30-32H,14,17,23,29,33H2,1-11H3/b13-12+,24-15+,25-16+,30-18+,32-19+,35-21+,36-22+,37-26+,38-27+,39-28+,40-31+
InChIKey FJOCMTHZSURUFA-AXYGSFPTSA-N
Properties
Density 0.898g/cm3 (Cal.)
Boiling point 671.09°C at 760 mmHg (Cal.)
Flash point 349.118°C (Cal.)
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