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(4H-3,5-DIMETHYL-1,2,4-TRIAZOLE-4-YLAMINO)-(4-METHYL-3-NITROPHENYL)-METHANOL
SpectraBase Compound ID 3VjZlU1oHOX
InChI InChI=1S/C12H15N5O3/c1-7-4-5-10(6-11(7)17(19)20)12(18)15-16-8(2)13-14-9(16)3/h4-6,12,15,18H,1-3H3
InChIKey UVOCBCHAEQRZTI-UHFFFAOYSA-N
Mol Weight 277.28 g/mol
Molecular Formula C12H15N5O3
Exact Mass 277.117489 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5JrbxVG7Usp
Name (4H-3,5-DIMETHYL-1,2,4-TRIAZOLE-4-YLAMINO)-(4-METHYL-3-NITROPHENYL)-METHANOL
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H15N5O3
InChI InChI=1S/C12H15N5O3/c1-7-4-5-10(6-11(7)17(19)20)12(18)15-16-8(2)13-14-9(16)3/h4-6,12,15,18H,1-3H3
InChIKey UVOCBCHAEQRZTI-UHFFFAOYSA-N
Literature Reference Author K.WAJDA-HERMANOWICZ,D.PIENIAZCZAK,A.ZATAJSKA,R.WROBEL,K.DRAB ENT,Z.CIUNIK
Literature Reference Citation MOLECULES,20,17109(2015)
Literature Reference DOI 10.3390/molecules200917109
Molecular Weight 277.283 g/mol
Solvent DMSO-D6
Source File Reference UWPA5168