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ESCHOLIDINE_PERCHLORATE

View entire compound with spectra: 2 NMR

ESCHOLIDINE_PERCHLORATE
SpectraBase Compound ID HtgtRMjFT6g
InChI InChI=1S/C20H21NO4.ClHO4/c1-21-6-5-13-8-18-19(25-11-24-18)9-14(13)16(21)7-12-3-4-17(23-2)20(22)15(12)10-21;2-1(3,4)5/h3-4,8-9,16H,5-7,10-11H2,1-2H3;(H,2,3,4,5)
InChIKey KJPJAJQDNRUXAT-UHFFFAOYSA-N
Mol Weight 439.85 g/mol
Molecular Formula C20H22ClNO8
Exact Mass 439.103394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AafjShsrDjt
Name ESCHOLIDINE_PERCHLORATE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H22ClNO8
InChI InChI=1S/C20H21NO4.ClHO4/c1-21-6-5-13-8-18-19(25-11-24-18)9-14(13)16(21)7-12-3-4-17(23-2)20(22)15(12)10-21;2-1(3,4)5/h3-4,8-9,16H,5-7,10-11H2,1-2H3;(H,2,3,4,5)
InChIKey KJPJAJQDNRUXAT-UHFFFAOYSA-N
Literature Reference Author S.CHUDIK,R.MAREK,P.SECKAFOVA,M.NECAS,J.DOSTAL,J.SLAVIK
Literature Reference Citation J.NAT.PROD.,69,954(2006)
Literature Reference DOI 10.1021/np060078e
Molecular Weight 439.850 g/mol
Solvent DMSO-D6
Source File Reference UWMZ18589