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5-METHYL-1-PHENYL-2-OXABICYLO-[3.1.0]-HEXAN-3-ONE
SpectraBase Compound ID LlM9VDiy7RU
InChI InChI=1S/C12H12O2/c1-11-7-10(13)14-12(11,8-11)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3/t11-,12-/m0/s1
InChIKey KUEMWTSSGJFZAR-RYUDHWBXSA-N
Mol Weight 188.23 g/mol
Molecular Formula C12H12O2
Exact Mass 188.08373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LDipsoIZJHR
Name 5-METHYL-1-PHENYL-2-OXABICYLO-[3.1.0]-HEXAN-3-ONE
Compound Number 6C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12O2
InChI InChI=1S/C12H12O2/c1-11-7-10(13)14-12(11,8-11)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3/t11-,12-/m0/s1
InChIKey KUEMWTSSGJFZAR-RYUDHWBXSA-N
Literature Reference Author J.BARLUENGA,F.AZNAR,I.GUTIERREZ,J.A.MARTINI
Literature Reference Citation ORG.LETTERS,4,2719(2002)
Literature Reference DOI 10.1021/ol026225r
Molecular Weight 188.226 g/mol
Sample ID 37449
Solvent CDCl3