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5-(HYDROXYMETHYL)-TUBERCIDIN
SpectraBase Compound ID 9YyOkAH5w4z
InChI InChI=1S/C12H16N4O5/c13-10-7-5(2-17)1-16(11(7)15-4-14-10)12-9(20)8(19)6(3-18)21-12/h1,4,6,8-9,12,17-20H,2-3H2,(H2,13,14,15)
InChIKey HVMYWBSUWVFUFB-UHFFFAOYSA-N
Mol Weight 296.28 g/mol
Molecular Formula C12H16N4O5
Exact Mass 296.11207 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7InrnYqjwxS
Name 5-(HYDROXYMETHYL)-TUBERCIDIN
CAS Registry Number 49558-38-5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16N4O5
InChI InChI=1S/C12H16N4O5/c13-10-7-5(2-17)1-16(11(7)15-4-14-10)12-9(20)8(19)6(3-18)21-12/h1,4,6,8-9,12,17-20H,2-3H2,(H2,13,14,15)
InChIKey HVMYWBSUWVFUFB-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 296.283 g/mol
Solvent DMSO-D6
Source File Reference UWWR741