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ISONAAMIDINE-D
SpectraBase Compound ID 66VPYWp2pUY
InChI InChI=1S/C21H19N5O4/c1-30-17-8-4-13(5-9-17)10-15-12-26(11-14-2-6-16(27)7-3-14)20(22-15)23-18-19(28)25-21(29)24-18/h2-9,12,27H,10-11H2,1H3,(H2,22,23,24,25,28,29)
InChIKey DUVWQFLGSQEPQQ-UHFFFAOYSA-N
Mol Weight 405.41 g/mol
Molecular Formula C21H19N5O4
Exact Mass 405.143704 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FgCrB6qV1jr
Name ISONAAMIDINE-D
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H19N5O4
InChI InChI=1S/C21H19N5O4/c1-30-17-8-4-13(5-9-17)10-15-12-26(11-14-2-6-16(27)7-3-14)20(22-15)23-18-19(28)25-21(29)24-18/h2-9,12,27H,10-11H2,1H3,(H2,22,23,24,25,28,29)
InChIKey DUVWQFLGSQEPQQ-UHFFFAOYSA-N
Literature Reference Author X.FU,F.J.SCHMITZ,R.S.TANNER,M.KELLY-BORGES
Literature Reference Citation J.NAT.PROD.,61,384(1998)
Literature Reference DOI 10.1021/np970453q
Molecular Weight 405.413 g/mol
Solvent CD3OD
Source File Reference UWRK3254