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(Z,Z,Z)-Tricycloheptaprenol (2'Z,6'Z,10'Z)-[1'-(Isocopal-12-en-15-yl)-2',6',10'-trimethyldodeca-2',6',10'-trien-12'-ol]
SpectraBase Compound ID GWEQXLUIOfa
InChI InChI=1S/C35H58O/c1-26(13-10-15-28(3)21-25-36)12-9-14-27(2)16-18-30-29(4)17-19-32-34(30,7)24-20-31-33(5,6)22-11-23-35(31,32)8/h13-14,17,21,30-32,36H,9-12,15-16,18-20,22-25H2,1-8H3/b26-13-,27-14-,28-21-/t30-,31+,32+,34+,35+/m0/s1
InChIKey TXTQQIZXTUHDCH-ONWHHDGISA-N
Mol Weight 494.8 g/mol
Molecular Formula C35H58O
Exact Mass 494.448766 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ArmdOE7ZL3V
Name (Z,Z,Z)-Tricycloheptaprenol (2'Z,6'Z,10'Z)-[1'-(Isocopal-12-en-15-yl)-2',6',10'-trimethyldodeca-2',6',10'-trien-12'-ol]
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Formula C35H58O
InChI InChI=1S/C35H58O/c1-26(13-10-15-28(3)21-25-36)12-9-14-27(2)16-18-30-29(4)17-19-32-34(30,7)24-20-31-33(5,6)22-11-23-35(31,32)8/h13-14,17,21,30-32,36H,9-12,15-16,18-20,22-25H2,1-8H3/b26-13-,27-14-,28-21-/t30-,31+,32+,34+,35+/m0/s1
InChIKey TXTQQIZXTUHDCH-ONWHHDGISA-N
Molecular Weight 494.848 g/mol
SMILES OC\C=C/(CC\C=C/(CC\C=C/(CC[C@@]1([C@@]2([C@]([C@]3([C@](C(CCC3)(C)C)([H])CC2)C)(CC=C1C)[H])C)[H])C)C)C
SPLASH splash10-00di-0290100000-ba1397cbe8c7463411fb
Source of Spectrum PS-54-118-2
Wiley ID 805192