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12-HYDROXYCHILOSCYPHONE
SpectraBase Compound ID Ijswq3EQHBP
InChI InChI=1S/C15H22O2/c1-10(9-16)14(17)13-8-7-12-6-4-5-11(2)15(12,13)3/h6,11,13,16H,1,4-5,7-9H2,2-3H3/t11-,13+,15+/m0/s1
InChIKey NEUJHRQRRDXWQD-NJZAAPMLSA-N
Mol Weight 234.34 g/mol
Molecular Formula C15H22O2
Exact Mass 234.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FP6kAAkLpG9
Name 1-[(1S,7S,7aS)-7,7a-dimethyl-1,2,3,5,6,7-hexahydroinden-1-yl]-2-(hydroxymethyl)-2-propen-1-one
Alternate Name(s) 1-[(1S,7S,7aS)-7,7a-dimethyl-1,2,3,5,6,7-hexahydroinden-1-yl]-2-(hydroxymethyl)prop-2-en-1-one 1-[(1S,7S,7aS)-7,7a-dimethyl-1,2,3,5,6,7-hexahydroinden-1-yl]-2-methylol-prop-2-en-1-one
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Formula C15H22O2
InChI InChI=1S/C15H22O2/c1-10(9-16)14(17)13-8-7-12-6-4-5-11(2)15(12,13)3/h6,11,13,16H,1,4-5,7-9H2,2-3H3/t11-,13+,15+/m0/s1
InChIKey NEUJHRQRRDXWQD-NJZAAPMLSA-N
Molecular Weight 234.339 g/mol
SMILES OCC(C([C@@]1([C@]2(C(=CCC[C@@]2(C)[H])CC1)C)[H])=O)=C
SPLASH splash10-052b-1900000000-f664d288a22529e47e0e
Source of Spectrum G4-60-1285-2
Wiley ID 1607014