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5-(METHOXYCARBONYL)-TUBERCIDIN
SpectraBase Compound ID BzU9IZji094
InChI InChI=1S/C13H16N4O6/c1-22-13(21)5-2-17(11-7(5)10(14)15-4-16-11)12-9(20)8(19)6(3-18)23-12/h2,4,6,8-9,12,18-20H,3H2,1H3,(H2,14,15,16)
InChIKey CEZTWGUUIVXSPB-UHFFFAOYSA-N
Mol Weight 324.29 g/mol
Molecular Formula C13H16N4O6
Exact Mass 324.106984 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I7HJ4WlQK4V
Name 5-(METHOXYCARBONYL)-TUBERCIDIN
CAS Registry Number 18440-68-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16N4O6
InChI InChI=1S/C13H16N4O6/c1-22-13(21)5-2-17(11-7(5)10(14)15-4-16-11)12-9(20)8(19)6(3-18)23-12/h2,4,6,8-9,12,18-20H,3H2,1H3,(H2,14,15,16)
InChIKey CEZTWGUUIVXSPB-UHFFFAOYSA-N
Literature Reference Author D.E.BERGSTROM,A.J.BRATTESANI,M.K.OGAWA,M.J.SCHWEICKERT
Literature Reference Citation J.ORG.CHEM.,46,1423(1981)
Literature Reference DOI 10.1021/jo00320a038
Molecular Weight 324.293 g/mol
Solvent DMSO-D6
Source File Reference UWWR740