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1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,5-dichloro-2-methoxyphenyl)methylidene]-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID 5PBF242FT3T
InChI InChI=1S/C16H17Cl2N9O3/c1-26(2)7-11-12(21-25-27(11)15-14(19)23-30-24-15)16(28)22-20-6-8-4-9(17)5-10(18)13(8)29-3/h4-6H,7H2,1-3H3,(H2,19,23)(H,22,28)/b20-6+
InChIKey WOYZAZJNQGKGNB-CGOBSMCZSA-N
Mol Weight 454.28 g/mol
Molecular Formula C16H17Cl2N9O3
Exact Mass 453.083141 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1QG9jps0max
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(3,5-dichloro-2-methoxyphenyl)methylidene]-5-[(dimethylamino)methyl]-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/C16H17Cl2N9O3/c1-26(2)7-11-12(21-25-27(11)15-14(19)23-30-24-15)16(28)22-20-6-8-4-9(17)5-10(18)13(8)29-3/h4-6H,7H2,1-3H3,(H2,19,23)(H,22,28)/b20-6+
InChIKey WOYZAZJNQGKGNB-CGOBSMCZSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3488
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: D11955; Labnumber: NIG-3742; SBI_ID: SBI-003490
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(3,5-dichloro-2-methoxyphenyl)methylidene]-5-[(dimethylamino)methyl]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 315 °C