John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=ELOW4D9sGVX SpectraBase Spectrum ID=1i6ilkOTMdS

(accessed ).
15-ACETOXY-1-BROMO-1,2-DIDEHYDRO-14-METHOXY-CYATHIN-A3
SpectraBase Compound ID ELOW4D9sGVX
InChI InChI=1S/C23H31BrO4/c1-13(2)16-9-19(24)21(4)7-8-22(5)17(20(16)21)10-18-15(12-27-14(3)25)11-23(22,26-6)28-18/h9,11,13,17-18H,7-8,10,12H2,1-6H3/t17-,18-,21?,22+,23-/m1/s1
InChIKey PKFLULGERWANSW-XKVOWVLDSA-N
Mol Weight 451.4 g/mol
Molecular Formula C23H31BrO4
Exact Mass 450.140571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1i6ilkOTMdS
Name 15-ACETOXY-1-BROMO-1,2-DIDEHYDRO-14-METHOXY-CYATHIN-A3
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H31BrO4
InChI InChI=1S/C23H31BrO4/c1-13(2)16-9-19(24)21(4)7-8-22(5)17(20(16)21)10-18-15(12-27-14(3)25)11-23(22,26-6)28-18/h9,11,13,17-18H,7-8,10,12H2,1-6H3/t17-,18-,21?,22+,23-/m1/s1
InChIKey PKFLULGERWANSW-XKVOWVLDSA-N
Literature Reference Author W.A.AYER,T.T.NAKASHIMA,D.E.WARD
Literature Reference Citation CAN.J.CHEM.,56,2197(1978)
Literature Reference DOI 10.1139/v78-360
Molecular Weight 451.401 g/mol
Solvent CDCl3
Source File Reference UWED73
SpectraBase Batch ID 5wKVupjOPCE