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GUANIDINIUM-TETRAETHYLCARBOXYLATE-BROMIDE-SALT
SpectraBase Compound ID FG6qb2DXGEt
InChI InChI=1S/C19H31N3O8.BrH/c1-5-27-13(23)18(14(24)28-6-2)9-11-22-12-10-19(15(25)29-7-3,16(26)30-8-4)21-17(22)20-18;/h17,20-21H,5-12H2,1-4H3;1H/p-1
InChIKey KPWNFUURHHCRBE-UHFFFAOYSA-M
Mol Weight 509.37 g/mol
Molecular Formula C19H31BrN3O8
Exact Mass 508.129453 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 44ZtsBLUccI
Name GUANIDINIUM-TETRAETHYLCARBOXYLATE-BROMIDE-SALT
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H31BrN3O8
InChI InChI=1S/C19H31N3O8.BrH/c1-5-27-13(23)18(14(24)28-6-2)9-11-22-12-10-19(15(25)29-7-3,16(26)30-8-4)21-17(22)20-18;/h17,20-21H,5-12H2,1-4H3;1H/p-1
InChIKey KPWNFUURHHCRBE-UHFFFAOYSA-M
Literature Reference Author V.D.JADHAV,F.P.SCHMIDTCHEN
Literature Reference Citation ORG.LETTERS,7,3311(2005)
Literature Reference DOI 10.1021/ol051109k
Molecular Weight 509.374 g/mol
Sample ID 57624
Solvent CD3CN