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(4S,4aR)-1,1-dimethyl-4-(1-methylethenyl)-7-oxo-3,4,5,6-tetrahydro-2H-naphthalene-4a-carbonitrile
SpectraBase Compound ID FBjDDZjK7Vb
InChI InChI=1S/C16H21NO/c1-11(2)13-6-7-15(3,4)14-9-12(18)5-8-16(13,14)10-17/h9,13H,1,5-8H2,2-4H3/t13-,16+/m0/s1
InChIKey DZPJETQITYUNNF-XJKSGUPXSA-N
Mol Weight 243.35 g/mol
Molecular Formula C16H21NO
Exact Mass 243.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9kYRVdu1WF8
Name (4S,4aR)-1,1-dimethyl-4-(1-methylethenyl)-7-oxo-3,4,5,6-tetrahydro-2H-naphthalene-4a-carbonitrile
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Formula C16H21NO
InChI InChI=1S/C16H21NO/c1-11(2)13-6-7-15(3,4)14-9-12(18)5-8-16(13,14)10-17/h9,13H,1,5-8H2,2-4H3/t13-,16+/m0/s1
InChIKey DZPJETQITYUNNF-XJKSGUPXSA-N
Molecular Weight 243.350 g/mol
SMILES [C@]12(C(=CC(CC2)=O)C(C)(C)CC[C@]1(C(=C)C)[H])C#N
SPLASH splash10-001u-9960000000-ed214f366bc33a5a9cf7
Source of Spectrum F-56-2091-24
Synonyms (4S,4aR)-1,1-dimethyl-7-oxidanylidene-4-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-naphthalene-4a-carbonitrile (4S,4aR)-1,1-dimethyl-7-oxo-4-prop-1-en-2-yl-3,4,5,6-tetrahydro-2H-naphthalene-4a-carbonitrile (4S,4aR)-4-isopropenyl-1,1-dimethyl-7-oxo-3,4,5,6-tetrahydro-2H-naphthalene-4a-carbonitrile (4S,4aR)-4-isopropenyl-7-keto-1,1-dimethyl-3,4,5,6-tetrahydro-2H-naphthalene-4a-carbonitrile
Wiley ID 856347