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6-FLUORO-1-METHYLCAMALEXIN
SpectraBase Compound ID 1xumx1Vja7N
InChI InChI=1S/C12H9FN2S/c1-15-7-10(12-14-4-5-16-12)9-3-2-8(13)6-11(9)15/h2-7H,1H3
InChIKey IRDSZBBGTIUIEW-UHFFFAOYSA-N
Mol Weight 232.28 g/mol
Molecular Formula C12H9FN2S
Exact Mass 232.047048 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gg0X4w7mkaq
Name 6-FLUORO-1-METHYLCAMALEXIN
Compound Number 1C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H9FN2S
InChI InChI=1S/C12H9FN2S/c1-15-7-10(12-14-4-5-16-12)9-3-2-8(13)6-11(9)15/h2-7H,1H3
InChIKey IRDSZBBGTIUIEW-UHFFFAOYSA-N
Literature Reference Author M.S.C.PEDRAS,P.W.K.AHIAHONU
Literature Reference Citation BIOORG.MED.CHEM.,10,3307(2002)
Literature Reference DOI 10.1016/S0968-0896(02)00208-0
Molecular Weight 232.275 g/mol
Sample ID 31295
Solvent CD3CN