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5(R)-[2(S)-Isoprpopyl-5(R)-methyl-(R)-cyclohexyloxy]-2(S)methyl-4-oxa-endo-tricyclo[5.2.1.0(2,6)]dec-8-en-3-one
SpectraBase Compound ID FUoRgI58J12
InChI InChI=1S/C20H30O3/c1-11(2)15-8-5-12(3)9-16(15)22-18-17-13-6-7-14(10-13)20(17,4)19(21)23-18/h6-7,11-18H,5,8-10H2,1-4H3/t12-,13-,14+,15+,16?,17?,18-,20+/m1/s1
InChIKey KIEDLNIPOHEWGS-KXUYVNAXSA-N
Mol Weight 318.46 g/mol
Molecular Formula C20H30O3
Exact Mass 318.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1z1MKL53Mu1
Name 5(R)-[2(S)-Isoprpopyl-5(R)-methyl-(R)-cyclohexyloxy]-2(S)methyl-4-oxa-endo-tricyclo[5.2.1.0(2,6)]dec-8-en-3-one
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Formula C20H30O3
InChI InChI=1S/C20H30O3/c1-11(2)15-8-5-12(3)9-16(15)22-18-17-13-6-7-14(10-13)20(17,4)19(21)23-18/h6-7,11-18H,5,8-10H2,1-4H3/t12-,13-,14+,15+,16?,17?,18-,20+/m1/s1
InChIKey KIEDLNIPOHEWGS-KXUYVNAXSA-N
Molecular Weight 318.457 g/mol
SMILES C1([C@@]2(C([C@]3(C[C@@]2(C=C3)[H])[H])[C@@](O1)(OC1[C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H])C)=O
SPLASH splash10-00lr-3900000000-45b7f7d7919a4799f240
Source of Spectrum F-51-5053-9
Synonyms (2S,5R)-5-[(2-isopropylcyclohexyl)oxy]-2,5-dimethyl-4-oxatricyclo[5.2.1.0(2,6)]dec-8-en-3-one
Wiley ID 791742