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2-METHYL-4-CARBOMETHOXY-5-CYANO-6,7-DIHYDROXY-HYDROISOQUINOLINE
SpectraBase Compound ID 9RE2AbSvbWG
InChI InChI=1S/C13H18N2O4/c1-15-5-7-3-10(16)12(17)8(4-14)11(7)9(6-15)13(18)19-2/h6-8,10-12,16-17H,3,5H2,1-2H3
InChIKey IRMAJXLZKPNTSO-UHFFFAOYSA-N
Mol Weight 266.3 g/mol
Molecular Formula C13H18N2O4
Exact Mass 266.126657 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CJUl1XrTDj9
Name 2-METHYL-4-CARBOMETHOXY-5-CYANO-6,7-DIHYDROXY-HYDROISOQUINOLINE
CAS Registry Number 120230-37-7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18N2O4
InChI InChI=1S/C13H18N2O4/c1-15-5-7-3-10(16)12(17)8(4-14)11(7)9(6-15)13(18)19-2/h6-8,10-12,16-17H,3,5H2,1-2H3
InChIKey IRMAJXLZKPNTSO-UHFFFAOYSA-N
Literature Reference Author E.W.BAXTER,D.LABAREE,S.CHAO,P.S.MARIANO
Literature Reference Citation J.ORG.CHEM.,54,2893(1989)
Literature Reference DOI 10.1021/jo00273a024
Molecular Weight 266.297 g/mol
Solvent CDCl3
Source File Reference UWGB1329