John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=8rGOyekmFdy SpectraBase Spectrum ID=10kU5Jq7t1f

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MALLONICUSIN_C
SpectraBase Compound ID 8rGOyekmFdy
InChI InChI=1S/C20H34O3/c1-13-7-9-17-19(3,4)18(23)10-11-20(17,5)15(13)8-6-14(2)16(22)12-21/h15-18,21-23H,1-2,6-12H2,3-5H3/t15-,16+,17-,18+,20+/m1/s1
InChIKey RJIUVLMJYKDXIC-GJNTUIEKSA-N
Mol Weight 322.5 g/mol
Molecular Formula C20H34O3
Exact Mass 322.250795 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 10kU5Jq7t1f
Name MALLONICUSIN_C
Compound Number 3
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H34O3
InChI InChI=1S/C20H34O3/c1-13-7-9-17-19(3,4)18(23)10-11-20(17,5)15(13)8-6-14(2)16(22)12-21/h15-18,21-23H,1-2,6-12H2,3-5H3/t15-,16+,17-,18+,20+/m1/s1
InChIKey RJIUVLMJYKDXIC-GJNTUIEKSA-N
Literature Reference Author D.Z.LI,C.TANG,R.J.QUINN,Y.FENG,C.Q.KE,S.YAO,Y.YE
Literature Reference Citation J.NAT.PROD.,76,1580(2013)
Literature Reference DOI 10.1021/np400241p
Molecular Weight 322.488 g/mol
Solvent CDCl3
Source File Reference UWMZ43118
SpectraBase Batch ID iGzmj2rQqo