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[1,2,4]triazolo[4,3-b]pyridazine, 6-(1H-1,2,3-benzotriazol-1-yl)-3-(trifluoromethyl)-
SpectraBase Compound ID 8JauDd9kzkE
InChI InChI=1S/C12H6F3N7/c13-12(14,15)11-18-17-9-5-6-10(19-22(9)11)21-8-4-2-1-3-7(8)16-20-21/h1-6H
InChIKey NLMXOVDKTMUSLJ-UHFFFAOYSA-N
Mol Weight 305.22 g/mol
Molecular Formula C12H6F3N7
Exact Mass 305.063678 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FhegKyVKc1v
Name [1,2,4]triazolo[4,3-b]pyridazine, 6-(1H-1,2,3-benzotriazol-1-yl)-3-(trifluoromethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 305.063677710 u
Formula C12H6F3N7
InChI InChI=1S/C12H6F3N7/c13-12(14,15)11-18-17-9-5-6-10(19-22(9)11)21-8-4-2-1-3-7(8)16-20-21/h1-6H
InChIKey NLMXOVDKTMUSLJ-UHFFFAOYSA-N
Molecular Weight 305.224 g/mol
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_530
Solvent DMSO-d6
Source Vendor ID: NMR/8295244; Lab Info: AS; Lab Number: AS-0000020
Temperature 23.85 °C