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(E)-1-[(3,4-DIMETHOXYCINNAMOYL)-AMINO]-3-GUANIDINOPROPANE-MESYLATE
SpectraBase Compound ID 4hSv3Zm9NBw
InChI InChI=1S/C15H22N4O3.CH4O3S/c1-21-12-6-4-11(10-13(12)22-2)5-7-14(20)18-8-3-9-19-15(16)17;1-5(2,3)4/h4-7,10H,3,8-9H2,1-2H3,(H,18,20)(H4,16,17,19);1H3,(H,2,3,4)/b7-5+;
InChIKey WEBAAGQPEADPRS-GZOLSCHFSA-N
Mol Weight 402.47 g/mol
Molecular Formula C16H26N4O6S
Exact Mass 402.157306 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HcjI7NtLshL
Name (E)-1-[(3,4-DIMETHOXYCINNAMOYL)-AMINO]-3-GUANIDINOPROPANE-MESYLATE
Compound Number 10C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H26N4O6S
InChI InChI=1S/C15H22N4O3.CH4O3S/c1-21-12-6-4-11(10-13(12)22-2)5-7-14(20)18-8-3-9-19-15(16)17;1-5(2,3)4/h4-7,10H,3,8-9H2,1-2H3,(H,18,20)(H4,16,17,19);1H3,(H,2,3,4)/b7-5+;
InChIKey WEBAAGQPEADPRS-GZOLSCHFSA-N
Literature Reference Author M.CARMIGNANI,A.R.VOLPE,B.BOTTA,R.ESPINAL,S.C.D.BONNEVAUX,C.D .L.M.BOTTA,F.CORELLI
Literature Reference Citation J.MED.CHEM.,44,2950(2001)
Literature Reference DOI 10.1021/jm001017v
Molecular Weight 402.466 g/mol
Sample ID 52828
Solvent Unknown