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[2R*-[2-ALPHA-(S*),1''-ALPHA,2''-ALPHA]]-2-[(4'''-BROMOPHENYL)-(2''-HYDROXYCYCLOHEXYLOXY)-METHYL]-CYCLOHEXAN-1-ONE
SpectraBase Compound ID H7fPRpieLDa
InChI InChI=1S/C19H25BrO3/c20-14-11-9-13(10-12-14)19(15-5-1-2-6-16(15)21)23-18-8-4-3-7-17(18)22/h9-12,15,17-19,22H,1-8H2/t15-,17?,18?,19-/m0/s1
InChIKey QZMDXZLVLWYFQJ-RXQRSOPUSA-N
Mol Weight 381.31 g/mol
Molecular Formula C19H25BrO3
Exact Mass 380.098708 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K3vZbxZi3ei
Name [2R*-[2-ALPHA-(S*),1''-ALPHA,2''-ALPHA]]-2-[(4'''-BROMOPHENYL)-(2''-HYDROXYCYCLOHEXYLOXY)-METHYL]-CYCLOHEXAN-1-ONE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H25BrO3
InChI InChI=1S/C19H25BrO3/c20-14-11-9-13(10-12-14)19(15-5-1-2-6-16(15)21)23-18-8-4-3-7-17(18)22/h9-12,15,17-19,22H,1-8H2/t15-,17?,18?,19-/m0/s1
InChIKey QZMDXZLVLWYFQJ-RXQRSOPUSA-N
Literature Reference Author R.C.CAMBIE,P.S.RUTLEDGE,P.A.WATSON,P.D.WOODGATE
Literature Reference Citation AUSTR.J.CHEM.,42,1939(1989)
Literature Reference DOI 10.1071/ch9891939
Molecular Weight 381.310 g/mol
Solvent Unknown
Source File Reference UWRU8740