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

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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-propyl-N'-{(E)-[2-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID KcYM6WnPVon
InChI InChI=1S/C16H15F3N8O2/c1-2-5-11-12(22-26-27(11)14-13(20)24-29-25-14)15(28)23-21-8-9-6-3-4-7-10(9)16(17,18)19/h3-4,6-8H,2,5H2,1H3,(H2,20,24)(H,23,28)/b21-8+
InChIKey NBKXLCQYOJQRKU-ODCIPOBUSA-N
Mol Weight 408.35 g/mol
Molecular Formula C16H15F3N8O2
Exact Mass 408.127006 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Et9e57hsSoo
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-propyl-N'-{(E)-[2-(trifluoromethyl)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/C16H15F3N8O2/c1-2-5-11-12(22-26-27(11)14-13(20)24-29-25-14)15(28)23-21-8-9-6-3-4-7-10(9)16(17,18)19/h3-4,6-8H,2,5H2,1H3,(H2,20,24)(H,23,28)/b21-8+
InChIKey NBKXLCQYOJQRKU-ODCIPOBUSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28094
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: D80352; Labnumber: NIG2-2414; SBI_ID: SBI-028098
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-propyl-N'-{[2-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Temperature 318 °C