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CRISPANONE;[1-S-[1-ALPHA,2-BETA-(Z),4A-ALPHA,8A-BETA]]-[1,2,4A,5,6,7,8,8A-OCTAHYDRO-1-HYDROXY-4,4A-DIMETHYL-1-(1-METHYLETHYL)-7-OXO-2-NAPHTHALENYL]
SpectraBase Compound ID 3p6aCl4RfbR
InChI InChI=1S/C20H30O4/c1-7-13(4)18(22)24-17-10-14(5)19(6)9-8-15(21)11-16(19)20(17,23)12(2)3/h7,10,12,16-17,23H,8-9,11H2,1-6H3/b13-7-/t16-,17+,19+,20+/m1/s1
InChIKey PWPPAEVQZGIEJV-BCLYJQJYSA-N
Mol Weight 334.46 g/mol
Molecular Formula C20H30O4
Exact Mass 334.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5tVqNiVTO7a
Name CRISPANONE;[1-S-[1-ALPHA,2-BETA-(Z),4A-ALPHA,8A-BETA]]-[1,2,4A,5,6,7,8,8A-OCTAHYDRO-1-HYDROXY-4,4A-DIMETHYL-1-(1-METHYLETHYL)-7-OXO-2-NAPHTHALENYL]
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H30O4
InChI InChI=1S/C20H30O4/c1-7-13(4)18(22)24-17-10-14(5)19(6)9-8-15(21)11-16(19)20(17,23)12(2)3/h7,10,12,16-17,23H,8-9,11H2,1-6H3/b13-7-/t16-,17+,19+,20+/m1/s1
InChIKey PWPPAEVQZGIEJV-BCLYJQJYSA-N
Literature Reference Author M.H.SPRAUL,S.NITZ,F.DRAWERT,H.DUDDECK,M.HIEGEMANN
Literature Reference Citation PHYTOCHEM.,31,3109(1992)
Literature Reference DOI 10.1016/0031-9422(92)83455-8
Molecular Weight 334.456 g/mol
Solvent CDCl3
Source File Reference UWMZ23480