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METHYL-2,19;15,16-DIEPOXY-NEO-CLERODAN-3,13(16),14-TRIEN-18-OATE
SpectraBase Compound ID GKSEREzlWEy
InChI InChI=1S/C21H28O4/c1-14-4-8-21-13-25-16(10-17(21)19(22)23-3)11-18(21)20(14,2)7-5-15-6-9-24-12-15/h6,9-10,12,14,16,18H,4-5,7-8,11,13H2,1-3H3/t14-,16+,18-,20+,21-/m1/s1
InChIKey YGUFDNBHUGMQGQ-AGNNOJMTSA-N
Mol Weight 344.45 g/mol
Molecular Formula C21H28O4
Exact Mass 344.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4C5CVZrSYqx
Name METHYL-2,19;15,16-DIEPOXY-NEO-CLERODAN-3,13(16),14-TRIEN-18-OATE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O4
InChI InChI=1S/C21H28O4/c1-14-4-8-21-13-25-16(10-17(21)19(22)23-3)11-18(21)20(14,2)7-5-15-6-9-24-12-15/h6,9-10,12,14,16,18H,4-5,7-8,11,13H2,1-3H3/t14-,16+,18-,20+,21-/m1/s1
InChIKey YGUFDNBHUGMQGQ-AGNNOJMTSA-N
Literature Reference Author V.E.J.HIKAWCZUK,P.C.ROSSOMANDO,O.S.GIORDANO,J.R.SAAD
Literature Reference Citation PHYTOCHEM.,61,389(2002)
Literature Reference DOI 10.1016/S0031-9422(02)00241-8
Molecular Weight 344.451 g/mol
Solvent CDCl3
Source File Reference UWLU29370