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(2R,3S,6R)-3-Methyl-2-(3-oxobutyl)-6-(prop-1-en-2-yl)-cycloheptanone
SpectraBase Compound ID J2BaSMejrTc
InChI InChI=1S/C15H24O2/c1-10(2)13-7-5-11(3)14(15(17)9-13)8-6-12(4)16/h11,13-14H,1,5-9H2,2-4H3/t11-,13+,14+/m0/s1
InChIKey CGLWYEZJKQTMLC-IACUBPJLSA-N
Mol Weight 236.35 g/mol
Molecular Formula C15H24O2
Exact Mass 236.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EoCGm4Fqmns
Name (2R,3S,6R)-3-Methyl-2-(3-oxobutyl)-6-(prop-1-en-2-yl)-cycloheptanone
Appearance Pale yellow liquid
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Formula C15H24O2
InChI InChI=1S/C15H24O2/c1-10(2)13-7-5-11(3)14(15(17)9-13)8-6-12(4)16/h11,13-14H,1,5-9H2,2-4H3/t11-,13+,14+/m0/s1
InChIKey CGLWYEZJKQTMLC-IACUBPJLSA-N
Instrument Name Agilent Technologies 6890-5973N
Ionization Type EI
Literature Reference DOI 10.1021/np500819f
Molecular Weight 236.355 g/mol
Reported Formula C15H24O2
SMILES C1(=O)C[C@](C(C)=C)(CC[C@](C)([C@]1(CCC(=O)C)[H])[H])[H]
SPLASH splash10-05tb-7910000000-42bc6ef7d8798f98ad25
Source of Spectrum G4-78-143-3b
Synonyms 1,7-di-epi-Chabrolidione A
Wiley ID 1865823