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(3S,4aR,5R)-3,8-Dimethyl-5-isopropyl-4,4a,5,6-tetrahydro-2(3H)-naphthalenone
SpectraBase Compound ID INlkSzjFZJu
InChI InChI=1S/C15H22O/c1-9(2)12-6-5-10(3)13-8-15(16)11(4)7-14(12)13/h5,8-9,11-12,14H,6-7H2,1-4H3/t11-,12+,14+/m0/s1
InChIKey MTZVTPNRLNIWQL-OUCADQQQSA-N
Mol Weight 218.34 g/mol
Molecular Formula C15H22O
Exact Mass 218.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KUs6VkXY3Q
Name (3S,4aR,5R)-3,8-Dimethyl-5-isopropyl-4,4a,5,6-tetrahydro-2(3H)-naphthalenone
Alternate Name(s) (3S,4aR,5R)-3,8-Dimethyl-5-isopropenyl-4,4a,5,6-tetrahydro-2(3H)-naphthalenone (3S,4aR,5R)-5-isopropyl-3,8-dimethyl-4,4a,5,6-tetrahydro-2(3H)-naphthalenone (3S,4aR,5R)-3,8-dimethyl-5-propan-2-yl-4,4a,5,6-tetrahydro-3H-naphthalen-2-one
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Formula C15H22O
InChI InChI=1S/C15H22O/c1-9(2)12-6-5-10(3)13-8-15(16)11(4)7-14(12)13/h5,8-9,11-12,14H,6-7H2,1-4H3/t11-,12+,14+/m0/s1
InChIKey MTZVTPNRLNIWQL-OUCADQQQSA-N
Molecular Weight 218.340 g/mol
SMILES C=12[C@@]([C@@](C(C)C)(CC=C2C)[H])(C[C@@](C(C1)=O)(C)[H])[H]
SPLASH splash10-001i-0910000000-4f88d2ff7cf6fcf4fdae
Source of Spectrum F-54-5630-26
Wiley ID 806935