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2-Methoxycarbonyl-2-methylbicyclo[4.1.0]heptan-5-one isomer
SpectraBase Compound ID IdVX7lcYfv4
InChI InChI=1S/C10H14O3/c1-10(9(12)13-2)4-3-8(11)6-5-7(6)10/h6-7H,3-5H2,1-2H3
InChIKey VMWAPAVHLZHVMV-UHFFFAOYSA-N
Mol Weight 182.22 g/mol
Molecular Formula C10H14O3
Exact Mass 182.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GkG8IN7YraE
Name 2-Methoxycarbonyl-2-methylbicyclo[4.1.0]heptan-5-one isomer
Alternate Name(s) 2-Methoxycarbonyl-2-methylbicyclo[4.1.0]heptan-5-one Methyl 2-methyl-5-oxobicyclo[4.1.0]heptane-2-carboxylate
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Formula C10H14O3
InChI InChI=1S/C10H14O3/c1-10(9(12)13-2)4-3-8(11)6-5-7(6)10/h6-7H,3-5H2,1-2H3
InChIKey VMWAPAVHLZHVMV-UHFFFAOYSA-N
Molecular Weight 182.219 g/mol
SMILES C12C(C(=O)CCC2(C(=O)OC)C)C1
SPLASH splash10-008a-9600000000-68c61abf483c09faca15
Source of Spectrum KC-57-1033-27
Wiley ID 1622738