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[2-NITRO-4-(TRIFLUOROMETHYL)-PHENYL]-(PYRIMIDIN-2-YLAMINO)-METHANOL
SpectraBase Compound ID La6hqNYPGve
InChI InChI=1S/C12H9F3N4O3/c13-12(14,15)7-2-3-8(9(6-7)19(21)22)10(20)18-11-16-4-1-5-17-11/h1-6,10,20H,(H,16,17,18)
InChIKey VGUMXXWWRAKLGD-UHFFFAOYSA-N
Mol Weight 314.22 g/mol
Molecular Formula C12H9F3N4O3
Exact Mass 314.062675 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID dqMMPqTXOV
Name [2-NITRO-4-(TRIFLUOROMETHYL)-PHENYL]-(PYRIMIDIN-2-YLAMINO)-METHANOL
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H9F3N4O3
InChI InChI=1S/C12H9F3N4O3/c13-12(14,15)7-2-3-8(9(6-7)19(21)22)10(20)18-11-16-4-1-5-17-11/h1-6,10,20H,(H,16,17,18)
InChIKey VGUMXXWWRAKLGD-UHFFFAOYSA-N
Literature Reference Author A.KWIECIEN,Z.CIUNIK
Literature Reference Citation MOLECULES,20,14365(2015)
Literature Reference DOI 10.3390/molecules200814365
Molecular Weight 314.224 g/mol
Solvent DMSO-D6
Source File Reference UWPA4138