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(1R,3R,5R,8S,9S)-5,10,10-Trimethyl-4-oxatricyclo[7.1.0(3,8)]undecane
SpectraBase Compound ID 9xarnhwoxe3
InChI InChI=1S/C13H22O/c1-8-4-5-10-11-6-9(13(11,2)3)7-12(10)14-8/h8-12H,4-7H2,1-3H3/t8-,9-,10-,11-,12-/m1/s1
InChIKey VJYRNIULRGQQPK-LZQZFOIKSA-N
Mol Weight 194.32 g/mol
Molecular Formula C13H22O
Exact Mass 194.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9H7SI7KmXuJ
Name (1R,3R,5R,8S,9S)-5,10,10-Trimethyl-4-oxatricyclo[7.1.0(3,8)]undecane
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Formula C13H22O
InChI InChI=1S/C13H22O/c1-8-4-5-10-11-6-9(13(11,2)3)7-12(10)14-8/h8-12H,4-7H2,1-3H3/t8-,9-,10-,11-,12-/m1/s1
InChIKey VJYRNIULRGQQPK-LZQZFOIKSA-N
Molecular Weight 194.318 g/mol
SMILES [C@]12(C([C@@](C[C@@]3([C@@]2(CC[C@@](C)(O3)[H])[H])[H])(C1)[H])(C)C)[H]
SPLASH splash10-004i-7900000000-0ac730a0936429f0f12c
Source of Spectrum J-70-1343-3h
Synonyms (1R,3R,5R,8S,9S)-5,10,10-Trimethyl-4-oxatricyclo[7.1.1.0(3,8)]undecane (2S,4aS,5S,7R)-2,6,6-trimethyloctahydro-2H-5,7-methanochromene
Wiley ID 1742607