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[1S,4aS,8aS] - 1,2,3,4,4a,7,8,8a - octahydro - 1,4a,6 - trimethyl - naphthalene
SpectraBase Compound ID CBJITKpLtae
InChI InChI=1S/C13H22/c1-10-6-7-12-11(2)5-4-8-13(12,3)9-10/h9,11-12H,4-8H2,1-3H3/t11-,12-,13+/m0/s1
InChIKey AWRODFUWOUCXQQ-RWMBFGLXSA-N
Mol Weight 178.32 g/mol
Molecular Formula C13H22
Exact Mass 178.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LBlkMQZ84nU
Name [1S,4aS,8aS] - 1,2,3,4,4a,7,8,8a - octahydro - 1,4a,6 - trimethyl - naphthalene
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Formula C13H22
InChI InChI=1S/C13H22/c1-10-6-7-12-11(2)5-4-8-13(12,3)9-10/h9,11-12H,4-8H2,1-3H3/t11-,12-,13+/m0/s1
InChIKey AWRODFUWOUCXQQ-RWMBFGLXSA-N
Molecular Weight 178.319 g/mol
SMILES [C@@]12(C=C(C)CC[C@]2([C@@](C)(CCC1)[H])[H])C
SPLASH splash10-055f-9600000000-53e9cb7950f135569227
Source of Spectrum Va-0-0-0
Synonyms (4S,4aS,8aS)-4,7,8a-trimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalene
Wiley ID 740028