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2-BENZYLOXY-1-[(1S)-1,2,2-TRIMETHYLCYCLOPENTYL]-HEXANE-1,5-DIONE

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2-BENZYLOXY-1-[(1S)-1,2,2-TRIMETHYLCYCLOPENTYL]-HEXANE-1,5-DIONE
SpectraBase Compound ID IbdPhRfGCaF
InChI InChI=1S/C21H30O3/c1-16(22)11-12-18(24-15-17-9-6-5-7-10-17)19(23)21(4)14-8-13-20(21,2)3/h5-7,9-10,18H,8,11-15H2,1-4H3/t18?,21-/m1/s1
InChIKey IBSXEZLVZSULTM-BDPMCISCSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EKbxdGjBNeR
Name 2-BENZYLOXY-1-[(1S)-1,2,2-TRIMETHYLCYCLOPENTYL]-HEXANE-1,5-DIONE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-16(22)11-12-18(24-15-17-9-6-5-7-10-17)19(23)21(4)14-8-13-20(21,2)3/h5-7,9-10,18H,8,11-15H2,1-4H3/t18?,21-/m1/s1
InChIKey IBSXEZLVZSULTM-BDPMCISCSA-N
Literature Reference Author A.ABAD,C.AGULLO,A.C.CUNAT,R.H.PERNI
Literature Reference Citation J.ORG.CHEM.,64,1741(1999)
Literature Reference DOI 10.1021/jo982020d
Molecular Weight 330.467 g/mol
Sample ID 39471
Solvent CDCl3