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PEDICIN

View entire compound with spectra: 1 NMR, and 1 MS (GC)

PEDICIN
SpectraBase Compound ID AV5lHW10WQq
InChI InChI=1S/C18H18O6/c1-22-16-13(12(19)10-9-11-7-5-4-6-8-11)14(20)17(23-2)18(24-3)15(16)21/h4-10,20-21H,1-3H3/b10-9+
InChIKey PPRMAMORBLMPSR-MDZDMXLPSA-N
Mol Weight 330.34 g/mol
Molecular Formula C18H18O6
Exact Mass 330.110338 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FWi1pkYyCUP
Name PEDICIN
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18O6
InChI InChI=1S/C18H18O6/c1-22-16-13(12(19)10-9-11-7-5-4-6-8-11)14(20)17(23-2)18(24-3)15(16)21/h4-10,20-21H,1-3H3/b10-9+
InChIKey PPRMAMORBLMPSR-MDZDMXLPSA-N
Literature Reference Author Y.ALIAS,K.AWANG,A.H.A.HADI,O.THOISON,T.SEVENET,M.PAIS
Literature Reference Citation J.NAT.PROD.,58,1160(1995)
Literature Reference DOI 10.1021/np50122a002
Molecular Weight 330.337 g/mol
Solvent CDCl3
Source File Reference UWPR2041