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ASPERDIOL-ACETATE
SpectraBase Compound ID 53sNNNIp548
InChI InChI=1S/C22H34O4/c1-15(2)19-10-8-16(3)7-6-12-22(5)21(26-22)11-9-18(13-20(19)24)14-25-17(4)23/h7,13,19-21,24H,1,6,8-12,14H2,2-5H3/b16-7-,18-13+/t19-,20-,21-,22-/m1/s1
InChIKey XHPIEOZMYVAMEY-NIRCSKOVSA-N
Mol Weight 362.5 g/mol
Molecular Formula C22H34O4
Exact Mass 362.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F0PuoBhL6dr
Name ASPERDIOL-ACETATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H34O4
InChI InChI=1S/C22H34O4/c1-15(2)19-10-8-16(3)7-6-12-22(5)21(26-22)11-9-18(13-20(19)24)14-25-17(4)23/h7,13,19-21,24H,1,6,8-12,14H2,2-5H3/b16-7-,18-13+/t19-,20-,21-,22-/m1/s1
InChIKey XHPIEOZMYVAMEY-NIRCSKOVSA-N
Literature Reference Author A.D.RODRIGUEZ,A.L.ACOSTA
Literature Reference Citation J.NAT.PROD.,60,1134(1997)
Literature Reference DOI 10.1021/np970373m
Molecular Weight 362.510 g/mol
Solvent CDCl3
Source File Reference WANG2324