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(3S,4S,4aR,8aS)-4a,5,6,8a-Tetrahydro-4,7-dimethyl-3,4-methylenennaphthalen-2(1H)-one
SpectraBase Compound ID Jlk4PH2NIaG
InChI InChI=1S/C13H18O/c1-8-3-4-10-9(5-8)6-12(14)11-7-13(10,11)2/h5,9-11H,3-4,6-7H2,1-2H3/t9-,10-,11-,13+/m1/s1
InChIKey MFQXLUWDRAJEAU-UZWSLXQKSA-N
Mol Weight 190.29 g/mol
Molecular Formula C13H18O
Exact Mass 190.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B9VsFAitlqJ
Name (3S,4S,4aR,8aS)-4a,5,6,8a-Tetrahydro-4,7-dimethyl-3,4-methylenennaphthalen-2(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O
InChI InChI=1S/C13H18O/c1-8-3-4-10-9(5-8)6-12(14)11-7-13(10,11)2/h5,9-11H,3-4,6-7H2,1-2H3/t9-,10-,11-,13+/m1/s1
InChIKey MFQXLUWDRAJEAU-UZWSLXQKSA-N
Literature Reference DOI 10.1002/hlca.200690025
Molecular Weight 190.286 g/mol
SMILES C=1(C)CC[C@@]2([C@@](C1)([H])CC([C@@]1([C@]2(C1)C)[H])=O)[H]
SPLASH splash10-00di-9000000000-cf39ef2cf9f37226c54e
Source of Spectrum H-89-235-7a
Synonyms (1aS,3aS,7aR,7bS)-1,1a,3,3a,6,7,7a,7b-Octahydro-5,7b-dimethyl-2H-cyclopropa[a]naphthalen-2-one (1aS,3aS,7aR,7bS)-5,7b-dimethyl-1,1a,3,3a,6,7,7a,7b-octahydro-2H-cyclopropa[a]naphthalen-2-one
Wiley ID 1785663