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3,7-Dimethyl-6,7-epoxyoctan-2-one
SpectraBase Compound ID IDkkWWKmVwa
InChI InChI=1S/C10H18O2/c1-7(8(2)11)5-6-9-10(3,4)12-9/h7,9H,5-6H2,1-4H3/t7-,9?/m0/s1
InChIKey NJWNABURHSJTJA-JAVCKPHESA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D96rvj2uWrv
Name 3,7-Dimethyl-6,7-epoxyoctan-2-one
Alternate Name(s) (3S,6R/S)-3,7-Dimethyl-6,7-epoxyoctan-2-one (3S)-5-(3,3-dimethyl-2-oxiranyl)-3-methyl-2-pentanone (S)-3,7-Dimethyl-6,7-epoxyoctan-2-one 5-(3,3-dimethyl-2-oxiranyl)-3-methyl-2-pentanone
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Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-7(8(2)11)5-6-9-10(3,4)12-9/h7,9H,5-6H2,1-4H3/t7-,9?/m0/s1
InChIKey NJWNABURHSJTJA-JAVCKPHESA-N
Molecular Weight 170.252 g/mol
SMILES C1(OC1CC[C@@](C(=O)C)(C)[H])(C)C
SPLASH splash10-0006-9000000000-f0c04166ee4ab20cb1d0
Source of Spectrum QF-49-719-5
Wiley ID 834143