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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-methoxyphenyl acetate

View entire compound with spectra: 1 NMR

4-[(E)-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazono)methyl]-2-methoxyphenyl acetate
SpectraBase Compound ID 1THgVsqlBwE
InChI InChI=1S/C18H20N8O5/c1-9(2)15-14(21-25-26(15)17-16(19)23-31-24-17)18(28)22-20-8-11-5-6-12(30-10(3)27)13(7-11)29-4/h5-9H,1-4H3,(H2,19,23)(H,22,28)/b20-8+
InChIKey MQASKXKCBFMTCU-DNTJNYDQSA-N
Mol Weight 428.41 g/mol
Molecular Formula C18H20N8O5
Exact Mass 428.155666 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5YsmB8U7joB
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-methoxyphenyl 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/C18H20N8O5/c1-9(2)15-14(21-25-26(15)17-16(19)23-31-24-17)18(28)22-20-8-11-5-6-12(30-10(3)27)13(7-11)29-4/h5-9H,1-4H3,(H2,19,23)(H,22,28)/b20-8+
InChIKey MQASKXKCBFMTCU-DNTJNYDQSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_23256
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: D37315; Labnumber: NIG1-2642; SBI_ID: SBI-023260
Synonyms 4-[({[1-(4-amino-1,2,5-oxadiazol-3-yl)-5-isopropyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazono)methyl]-2-methoxyphenyl acetate
Temperature 315 °C