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CYNAROPICRIN-DIMETHYLAMINE-ADDUCT-HYDROCHLORIDE
SpectraBase Compound ID 3fxVmKeXjlQ
InChI InChI=1S/C21H29NO6.ClH/c1-10-6-16(27-20(25)11(2)9-23)18-14(8-22(4)5)21(26)28-19(18)17-12(3)15(24)7-13(10)17;/h13-19,23-24H,1-3,6-9H2,4-5H3;1H/t13-,14-,15-,16-,17-,18+,19+;/m0./s1
InChIKey KALPRGLLYOELOK-PFAWVPQESA-N
Mol Weight 427.93 g/mol
Molecular Formula C21H30ClNO6
Exact Mass 427.176165 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JKhuDMEKey7
Name CYNAROPICRIN-DIMETHYLAMINE-ADDUCT-HYDROCHLORIDE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30ClNO6
InChI InChI=1S/C21H29NO6.ClH/c1-10-6-16(27-20(25)11(2)9-23)18-14(8-22(4)5)21(26)28-19(18)17-12(3)15(24)7-13(10)17;/h13-19,23-24H,1-3,6-9H2,4-5H3;1H/t13-,14-,15-,16-,17-,18+,19+;/m0./s1
InChIKey KALPRGLLYOELOK-PFAWVPQESA-N
Literature Reference Author S.ZIMMERMANN,G.FOUCHE,M.D.MIERI,Y.YOSHIMOTO,T.USUKI,R.NTHAMB ELENI,C.J.PARKINSON
Literature Reference Citation MOLECULES,19,3523(2014)
Literature Reference DOI 10.3390/molecules19033523
Molecular Weight 427.925 g/mol
Solvent CD3OD
Source File Reference UWBT14444