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(1S,3R,4R,6R)-3-[(2R,3aS,6aR)-Hexahydrofurano[2,3-b]furan-2-yl]-6-isopropenyl-3,4-dimethyl-2-oxocyclohexanecarbonitrile
SpectraBase Compound ID KCbvGxE0PC
InChI InChI=1S/C18H25NO3/c1-10(2)13-7-11(3)18(4,16(20)14(13)9-19)15-8-12-5-6-21-17(12)22-15/h11-15,17H,1,5-8H2,2-4H3/t11-,12+,13+,14-,15-,17-,18-/m1/s1
InChIKey OLYMEBOTYZNMOK-DAMORXRNSA-N
Mol Weight 303.4 g/mol
Molecular Formula C18H25NO3
Exact Mass 303.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7dnK21mgzgy
Name (1S,3R,4R,6R)-3-[(2R,3aS,6aR)-Hexahydrofurano[2,3-b]furan-2-yl]-6-isopropenyl-3,4-dimethyl-2-oxocyclohexanecarbonitrile
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Formula C18H25NO3
InChI InChI=1S/C18H25NO3/c1-10(2)13-7-11(3)18(4,16(20)14(13)9-19)15-8-12-5-6-21-17(12)22-15/h11-15,17H,1,5-8H2,2-4H3/t11-,12+,13+,14-,15-,17-,18-/m1/s1
InChIKey OLYMEBOTYZNMOK-DAMORXRNSA-N
Molecular Weight 303.402 g/mol
SMILES [C@@]1(C([C@](C#N)([C@@](C[C@]1(C)[H])(C(=C)C)[H])[H])=O)([C@@]1(O[C@]2(OCC[C@]2(C1)[H])[H])[H])C
SPLASH splash10-03di-6900000000-d3cf2c1fcdbb2296e937
Source of Spectrum F-56-2086-14
Synonyms (1S,3R,4R,6R)-3-[(3aS,5R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-5-yl]-3,4-dimethyl-6-(1-methylethenyl)-2-oxo-1-cyclohexanecarbonitrile (1S,3R,4R,6R)-3-[(3aS,5R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-5-yl]-3,4-dimethyl-2-oxo-6-prop-1-en-2-ylcyclohexane-1-carbonitrile (1S,3R,4R,6R)-3-[(3aS,5R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-5-yl]-6-isopropenyl-3,4-dimethyl-2-oxo-cyclohexanecarbonitrile (1S,3R,4R,6R)-3-[(3aS,5R,6aR)-2,3,3a,4,5,6a-hexahydrofuro[2,3-b]furan-5-yl]-3,4-dimethyl-2-oxidanylidene-6-prop-1-en-2-yl-cyclohexane-1-carbonitrile
Wiley ID 856377