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(3AR*,7R*7AS*)-7-PHENYL-1,3,3A,4,5,6,7,7A-OCTAHYDROISOBENZOFURAN-1-ONE
SpectraBase Compound ID JDZ1i7QNVhC
InChI InChI=1S/C14H16O2/c15-14-13-11(9-16-14)7-4-8-12(13)10-5-2-1-3-6-10/h1-3,5-6,11-13H,4,7-9H2
InChIKey KFXMVFVBSHFNEF-UHFFFAOYSA-N
Mol Weight 216.28 g/mol
Molecular Formula C14H16O2
Exact Mass 216.11503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F4JoCbAW6Ng
Name (3AR*,7R*7AS*)-7-PHENYL-1,3,3A,4,5,6,7,7A-OCTAHYDROISOBENZOFURAN-1-ONE
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H16O2
InChI InChI=1S/C14H16O2/c15-14-13-11(9-16-14)7-4-8-12(13)10-5-2-1-3-6-10/h1-3,5-6,11-13H,4,7-9H2
InChIKey KFXMVFVBSHFNEF-UHFFFAOYSA-N
Literature Reference Author O.MURAOKA,G.TANABE,Y.IGAKI
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1669(1997)
Literature Reference DOI 10.1039/a608122c
Molecular Weight 216.280 g/mol
Solvent CDCl3
Source File Reference UWRU10009