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4-[(E)-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazono)methyl]-2-ethoxyphenyl acetate

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4-[(E)-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazono)methyl]-2-ethoxyphenyl acetate
SpectraBase Compound ID 5jMD18KVR3m
InChI InChI=1S/C19H22N8O5/c1-5-30-14-8-12(6-7-13(14)31-11(4)28)9-21-23-19(29)15-16(10(2)3)27(26-22-15)18-17(20)24-32-25-18/h6-10H,5H2,1-4H3,(H2,20,24)(H,23,29)/b21-9+
InChIKey DVOUUWNMDADDSV-ZVBGSRNCSA-N
Mol Weight 442.44 g/mol
Molecular Formula C19H22N8O5
Exact Mass 442.171316 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID H8Sg2jE8DRg
Name 4-[(E)-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazono)methyl]-2-ethoxyphenyl acetate
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/C19H22N8O5/c1-5-30-14-8-12(6-7-13(14)31-11(4)28)9-21-23-19(29)15-16(10(2)3)27(26-22-15)18-17(20)24-32-25-18/h6-10H,5H2,1-4H3,(H2,20,24)(H,23,29)/b21-9+
InChIKey DVOUUWNMDADDSV-ZVBGSRNCSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23218
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: D37238; Labnumber: NIG1-2424; SBI_ID: SBI-023222
Synonyms 4-[({[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazono)methyl]-2-ethoxyphenyl acetate
Temperature 315 °C