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PENTANDRANOIC-ACID-B;2,12-DIOXO-A-NORCLEROD-13(16)-EN-15-OIC-ACID
SpectraBase Compound ID 8qAlxZfQw9U
InChI InChI=1S/C19H28O4/c1-11(8-17(22)23)15(21)10-19(5)12(2)6-7-18(4)13(3)14(20)9-16(18)19/h12-13,16H,1,6-10H2,2-5H3,(H,22,23)/t12-,13-,16+,18+,19+/m1/s1
InChIKey SBAJVJRZBWJEIA-FZGRFCFCSA-N
Mol Weight 320.43 g/mol
Molecular Formula C19H28O4
Exact Mass 320.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jvg90bJmKAo
Name PENTANDRANOIC-ACID-B;2,12-DIOXO-A-NORCLEROD-13(16)-EN-15-OIC-ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H28O4
InChI InChI=1S/C19H28O4/c1-11(8-17(22)23)15(21)10-19(5)12(2)6-7-18(4)13(3)14(20)9-16(18)19/h12-13,16H,1,6-10H2,2-5H3,(H,22,23)/t12-,13-,16+,18+,19+/m1/s1
InChIKey SBAJVJRZBWJEIA-FZGRFCFCSA-N
Literature Reference Author J.XU,L.J.HARRISON,J.J.VITTAL,Y.J.XU,S.H.GOH
Literature Reference Citation J.NAT.PROD.,63,1062(2000)
Literature Reference DOI 10.1021/np990584m
Molecular Weight 320.429 g/mol
Solvent CDCl3
Source File Reference UWRU7344