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2-N,4-N-ditert-butyl-6-[4-(tetrazolo[1,5-b]pyridazin-6-yl)piperazin-1-yl]-1,3,5-triazine-2,4-diamine
SpectraBase Compound ID AK5h7ZoxJGJ
InChI InChI=1S/C19H30N12/c1-18(2,3)23-15-20-16(24-19(4,5)6)22-17(21-15)30-11-9-29(10-12-30)14-8-7-13-25-27-28-31(13)26-14/h7-8H,9-12H2,1-6H3,(H2,20,21,22,23,24)
InChIKey CBWCLNLMBBPSJJ-UHFFFAOYSA-N
Mol Weight 426.53 g/mol
Molecular Formula C19H30N12
Exact Mass 426.271639 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1qFkBcP7rGT
Name 1,3,5-triazine-2,4-diamine, N~2~,N~4~-bis(1,1-dimethylethyl)-6-(4-tetrazolo[1,5-b]pyridazin-6-yl-1-piperazinyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 426.271639014 u
Formula C19H30N12
InChI InChI=1S/C19H30N12/c1-18(2,3)23-15-20-16(24-19(4,5)6)22-17(21-15)30-11-9-29(10-12-30)14-8-7-13-25-27-28-31(13)26-14/h7-8H,9-12H2,1-6H3,(H2,20,21,22,23,24)
InChIKey CBWCLNLMBBPSJJ-UHFFFAOYSA-N
Molecular Weight 426.533 g/mol
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_404
Solvent DMSO-d6
Source Vendor ID: NMR/8295234; Lab Info: AS; Lab Number: AS-0000010
Temperature 23.85 °C