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3-[3-[(2R,4aR,8aR)-4a,8-dimethyl-2,3,4,5,6,8a-hexahydro-1H-naphthalen-2-yl]but-3-enyl]-2,2-dimethyloxirane
SpectraBase Compound ID 5eSgzrw3tA9
InChI InChI=1S/C20H32O/c1-14(8-9-18-19(3,4)21-18)16-10-12-20(5)11-6-7-15(2)17(20)13-16/h7,16-18H,1,6,8-13H2,2-5H3/t16-,17+,18?,20-/m1/s1
InChIKey MIDZNGCODQSQLQ-NHJHPMQKSA-N
Mol Weight 288.5 g/mol
Molecular Formula C20H32O
Exact Mass 288.245316 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID TyIRY6zaHC
Name 3-[3-[(2R,4aR,8aR)-4a,8-dimethyl-2,3,4,5,6,8a-hexahydro-1H-naphthalen-2-yl]but-3-enyl]-2,2-dimethyloxirane
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32O
InChI InChI=1S/C20H32O/c1-14(8-9-18-19(3,4)21-18)16-10-12-20(5)11-6-7-15(2)17(20)13-16/h7,16-18H,1,6,8-13H2,2-5H3/t16-,17+,18?,20-/m1/s1
InChIKey MIDZNGCODQSQLQ-NHJHPMQKSA-N
Literature Reference Author L.LI,L.SHENG,C.Y.WANG,Y.B.ZHOU,H.HUANG,X.B.LI,J.LI,E.MOLLO,M .GAVAGNIN,Y.W.GUO
Literature Reference Citation J.NAT.PROD.,74,2089(2011)
Literature Reference DOI 10.1021/np2003325
Molecular Weight 288.473 g/mol
Sample ID 39337
Solvent CDCl3