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(+)-(1S,4S,7R)-8,8-Dimethyl-4-hydroxymethylbicyclo[5.1.0]octan-3-one

View entire compound with spectra: 1 MS (GC)

(+)-(1S,4S,7R)-8,8-Dimethyl-4-hydroxymethylbicyclo[5.1.0]octan-3-one
SpectraBase Compound ID 9gNpOFy0up8
InChI InChI=1S/C11H18O2/c1-11(2)8-4-3-7(6-12)10(13)5-9(8)11/h7-9,12H,3-6H2,1-2H3/t7-,8+,9-/m0/s1
InChIKey NGDOUAZDCZWVND-YIZRAAEISA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Q6Apk250Q8
Name (+)-(1S,4S,7R)-8,8-Dimethyl-4-hydroxymethylbicyclo[5.1.0]octan-3-one
Comments Less than 3 mono-isotopic peaks
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Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-11(2)8-4-3-7(6-12)10(13)5-9(8)11/h7-9,12H,3-6H2,1-2H3/t7-,8+,9-/m0/s1
InChIKey NGDOUAZDCZWVND-YIZRAAEISA-N
Molecular Weight 182.263 g/mol
SMILES OC[C@]1(C(C[C@@]2(C(C)(C)[C@@]2(CC1)[H])[H])=O)[H]
SPLASH splash10-001i-9100000000-5be2dd7f3675be69d9ea
Source of Spectrum F-52-4263-16
Synonyms (1S,4S,7R)-4-(hydroxymethyl)-8,8-dimethylbicyclo[5.1.0]octan-3-one
Wiley ID 796042