John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4qgn8aDTBZd SpectraBase Spectrum ID=11qoZUUxsgV

(accessed ).
9-HYDROXY-ISOASCIDIDEMIN;STRUCTURE-I
SpectraBase Compound ID 4qgn8aDTBZd
InChI InChI=1S/C18H9N3O2/c22-12-6-8-19-15-14(12)18(23)17-13-10(5-7-20-17)9-3-1-2-4-11(9)21-16(13)15/h1-8H,(H,19,22)
InChIKey WSVYZSQXPUTYLB-UHFFFAOYSA-N
Mol Weight 299.29 g/mol
Molecular Formula C18H9N3O2
Exact Mass 299.069477 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 11qoZUUxsgV
Name 9-HYDROXY-ISOASCIDIDEMIN;STRUCTURE-I;KETO-FORM
Compound Number 5
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H9N3O2
InChI InChI=1S/C18H9N3O2/c22-12-6-8-19-15-14(12)18(23)17-13-10(5-7-20-17)9-3-1-2-4-11(9)21-16(13)15/h1-8H,(H,19,22)
InChIKey WSVYZSQXPUTYLB-UHFFFAOYSA-N
Literature Reference Author T.D.TRAN,N.B.PHAM,R.J.QUINN
Literature Reference Citation EUR.J.ORG.CHEM.,2014,4805(2014)
Literature Reference DOI 10.1002/ejoc.201402372
Molecular Weight 299.288 g/mol
Solvent DMSO-D6
Source File Reference UWIR20061
SpectraBase Batch ID jhwnwBeD3i