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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(E)-mesitylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID COcCayHCuSM
InChI InChI=1S/C23H31N9O2/c1-14-10-15(2)18(16(3)11-14)12-25-27-23(33)20-19(13-31(4)17-8-6-5-7-9-17)32(30-26-20)22-21(24)28-34-29-22/h10-12,17H,5-9,13H2,1-4H3,(H2,24,28)(H,27,33)/b25-12+
InChIKey YIXNPWIEFULDLV-BRJLIKDPSA-N
Mol Weight 465.56 g/mol
Molecular Formula C23H31N9O2
Exact Mass 465.260071 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9UanCsWM8p1
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(E)-mesitylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C23H31N9O2/c1-14-10-15(2)18(16(3)11-14)12-25-27-23(33)20-19(13-31(4)17-8-6-5-7-9-17)32(30-26-20)22-21(24)28-34-29-22/h10-12,17H,5-9,13H2,1-4H3,(H2,24,28)(H,27,33)/b25-12+
InChIKey YIXNPWIEFULDLV-BRJLIKDPSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13086
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D79936; Labnumber: NIG2-0153; SBI_ID: SBI-013089
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[mesitylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 315 °C