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

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1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID 8UW6vFTRWZx
InChI InChI=1S/C16H15F3N8O2/c1-8(2)12-11(22-26-27(12)14-13(20)24-29-25-14)15(28)23-21-7-9-3-5-10(6-4-9)16(17,18)19/h3-8H,1-2H3,(H2,20,24)(H,23,28)/b21-7+
InChIKey YKJYHCFDMSVOOJ-QPSGOUHRSA-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 LxexVM5odsn
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-{(E)-[4-(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/c1-8(2)12-11(22-26-27(12)14-13(20)24-29-25-14)15(28)23-21-7-9-3-5-10(6-4-9)16(17,18)19/h3-8H,1-2H3,(H2,20,24)(H,23,28)/b21-7+
InChIKey YKJYHCFDMSVOOJ-QPSGOUHRSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23247
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: D37295; Labnumber: NIG1-2599; SBI_ID: SBI-023251
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-N'-{[4-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Temperature 315 °C