1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-((E)-{4-[(4-fluorobenzyl)oxy]phenyl}methylidene)-1H-1,2,3-triazole-4-carbohydrazide

SpectraBase Compound ID	7mXjZougFxs
InChI	InChI=1S/C22H22FN9O3/c1-31(2)12-18-19(26-30-32(18)21-20(24)28-35-29-21)22(33)27-25-11-14-5-9-17(10-6-14)34-13-15-3-7-16(23)8-4-15/h3-11H,12-13H2,1-2H3,(H2,24,28)(H,27,33)/b25-11+
InChIKey	QMLLFANDMCADHM-OPEKNORGSA-N Google Search
Mol Weight	479.48 g/mol
Molecular Formula	C22H22FN9O3
Exact Mass	479.182964 g/mol

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SpectraBase Spectrum ID	K9UpxBPeDZ8
Name	1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-((E)-{4-[(4-fluorobenzyl)oxy]phenyl}methylidene)-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/C22H22FN9O3/c1-31(2)12-18-19(26-30-32(18)21-20(24)28-35-29-21)22(33)27-25-11-14-5-9-17(10-6-14)34-13-15-3-7-16(23)8-4-15/h3-11H,12-13H2,1-2H3,(H2,24,28)(H,27,33)/b25-11+
InChIKey	QMLLFANDMCADHM-OPEKNORGSA-N
NMR Offset	15.5012
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_SBI_36227_23336
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: D37443; Labnumber: NIG1-3034; SBI_ID: SBI-023340
Synonyms	1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-({4-[(4-fluorobenzyl)oxy]phenyl}methylidene)-1H-1,2,3-triazole-4-carbohydrazide
Temperature	315 °C