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3,4:11,12-BISEPOXY-15-METHOXY-1(E),7(E)-CEMBrADIENE
SpectraBase Compound ID K99MxKTOZIU
InChI InChI=1S/C21H34O3/c1-15-8-7-12-20(4)18(24-20)14-16(19(2,3)22-6)11-13-21(5)17(23-21)10-9-15/h8,14,17-18H,7,9-13H2,1-6H3/b15-8+,16-14+/t17-,18-,20+,21+/m0/s1
InChIKey MHCZPWKKJRTQEQ-UJLJGIAQSA-N
Mol Weight 334.5 g/mol
Molecular Formula C21H34O3
Exact Mass 334.250795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ETmolp4XbMo
Name 3,4:11,12-BISEPOXY-15-METHOXY-1(E),7(E)-CEMBrADIENE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H34O3
InChI InChI=1S/C21H34O3/c1-15-8-7-12-20(4)18(24-20)14-16(19(2,3)22-6)11-13-21(5)17(23-21)10-9-15/h8,14,17-18H,7,9-13H2,1-6H3/b15-8+,16-14+/t17-,18-,20+,21+/m0/s1
InChIKey MHCZPWKKJRTQEQ-UJLJGIAQSA-N
Literature Reference Author C.Y.DUH,R.S.HOU
Literature Reference Citation J.NAT.PROD.,59,595(1996)
Literature Reference DOI 10.1021/np960174n
Molecular Weight 334.499 g/mol
Solvent CDCl3
Source File Reference UWRK862