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(4-CYANOPHENYL)-(4H-3,5-DIMETHYL-1,2,4-TRIAZOLE-4-YLAMINO)-METHANOL
SpectraBase Compound ID 3cF6wXsX7Oq
InChI InChI=1S/C12H13N5O/c1-8-14-15-9(2)17(8)16-12(18)11-5-3-10(7-13)4-6-11/h3-6,12,16,18H,1-2H3
InChIKey HPFPPWFWJABNRO-UHFFFAOYSA-N
Mol Weight 243.27 g/mol
Molecular Formula C12H13N5O
Exact Mass 243.11201 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7bii0PI2t2v
Name (4-CYANOPHENYL)-(4H-3,5-DIMETHYL-1,2,4-TRIAZOLE-4-YLAMINO)-METHANOL
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13N5O
InChI InChI=1S/C12H13N5O/c1-8-14-15-9(2)17(8)16-12(18)11-5-3-10(7-13)4-6-11/h3-6,12,16,18H,1-2H3
InChIKey HPFPPWFWJABNRO-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 243.268 g/mol
Solvent DMSO-D6
Source File Reference UWPA5172