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1-[(4-METHOXYBENZOYL)-AMINO]-4-GUANIDINOBUTANE-MESYLATE
SpectraBase Compound ID 1r5dnKAyjdo
InChI InChI=1S/C18H28N4O2.CH4O3S/c1-14(2)10-13-22-18(19)21-12-5-4-11-20-17(23)15-6-8-16(24-3)9-7-15;1-5(2,3)4/h6-10H,4-5,11-13H2,1-3H3,(H,20,23)(H3,19,21,22);1H3,(H,2,3,4)
InChIKey IWLRBISYFHXUAE-UHFFFAOYSA-N
Mol Weight 428.55 g/mol
Molecular Formula C19H32N4O5S
Exact Mass 428.209341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J7Oh2mKI5Xu
Name 1-[(4-METHOXYBENZOYL)-AMINO]-4-GUANIDINOBUTANE-MESYLATE
Compound Number 16A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H32N4O5S
InChI InChI=1S/C18H28N4O2.CH4O3S/c1-14(2)10-13-22-18(19)21-12-5-4-11-20-17(23)15-6-8-16(24-3)9-7-15;1-5(2,3)4/h6-10H,4-5,11-13H2,1-3H3,(H,20,23)(H3,19,21,22);1H3,(H,2,3,4)
InChIKey IWLRBISYFHXUAE-UHFFFAOYSA-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 428.547 g/mol
Sample ID 52831
Solvent Unknown