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4-[(1aR,3aS,4R,7aR,7bS)-3a,7b-dimethyl-5-methylene-1,1a,2,3,4,6,7,7a-octahydrocyclopropa[a]naphthalen-4-yl]-2-butanone
SpectraBase Compound ID AOIFAU2iwob
InChI InChI=1S/C18H28O/c1-12-5-8-16-17(3,15(12)7-6-13(2)19)10-9-14-11-18(14,16)4/h14-16H,1,5-11H2,2-4H3/t14-,15-,16+,17+,18+/m1/s1
InChIKey CGZDCBHFVVUOGJ-ZBRFXRBCSA-N
Mol Weight 260.42 g/mol
Molecular Formula C18H28O
Exact Mass 260.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DFCkn1dmGWG
Name 4-[(1aR,3aS,4R,7aR,7bS)-3a,7b-dimethyl-5-methylene-1,1a,2,3,4,6,7,7a-octahydrocyclopropa[a]naphthalen-4-yl]-2-butanone
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Formula C18H28O
InChI InChI=1S/C18H28O/c1-12-5-8-16-17(3,15(12)7-6-13(2)19)10-9-14-11-18(14,16)4/h14-16H,1,5-11H2,2-4H3/t14-,15-,16+,17+,18+/m1/s1
InChIKey CGZDCBHFVVUOGJ-ZBRFXRBCSA-N
Molecular Weight 260.421 g/mol
SMILES [C@]12([C@@]3([C@@]([C@](CCC(=O)C)(C(CC3)=C)[H])(C)CC[C@]1([H])C2)[H])C
SPLASH splash10-0zic-0490000000-578c8a8ca56af189443d
Source of Spectrum KC-0-1842-20
Synonyms 4-[(1aR,3aS,4R,7aR,7bS)-3a,7b-dimethyl-5-methylene-1,1a,2,3,4,6,7,7a-octahydrocyclopropa[a]naphthalen-4-yl]butan-2-one 4-[(1aR,3aS,4R,7aR,7bS)-3a,7b-dimethyl-5-methylidene-1,1a,2,3,4,6,7,7a-octahydrocyclopropa[a]naphthalen-4-yl]butan-2-one
Wiley ID 822627