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(1R,2S,4R)-1,2,4-Trimethyl-8-oxabicyclo[3.2.1]oct-3-one isomer

View entire compound with spectra: 1 MS (GC)

(1R,2S,4R)-1,2,4-Trimethyl-8-oxabicyclo[3.2.1]oct-3-one isomer
SpectraBase Compound ID IrCZ76kT1YE
InChI InChI=1S/C10H16O2/c1-6-8-4-5-10(3,12-8)7(2)9(6)11/h6-8H,4-5H2,1-3H3/t6-,7-,8?,10-/m1/s1
InChIKey UHLVAPKPJGWEEU-VZTUGXDPSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DbOP0erc2Pr
Name (1R,2S,4R)-1,2,4-Trimethyl-8-oxabicyclo[3.2.1]oct-3-one isomer
Alternate Name(s) (1R,2S,4R)-1,2,4-trimethyl-8-oxabicyclo[3.2.1]octan-3-one 1,2,4-Trimethyl-8-oxabicyclo[3.2.1]oct-3-one isomer
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Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-6-8-4-5-10(3,12-8)7(2)9(6)11/h6-8H,4-5H2,1-3H3/t6-,7-,8?,10-/m1/s1
InChIKey UHLVAPKPJGWEEU-VZTUGXDPSA-N
Molecular Weight 168.236 g/mol
SMILES [C@@]12(OC(CC2)[C@](C([C@]1(C)[H])=O)(C)[H])C
SPLASH splash10-017u-9600000000-5efd09da1bff52dc4a01
Source of Spectrum F-55-621-8
Wiley ID 836630