For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
SpectraBase Compound ID 2eDcyaM4K7v
InChI InChI=1S/C22H29N9O5/c1-30(14-7-5-4-6-8-14)12-15-18(25-29-31(15)21-20(23)27-36-28-21)22(33)26-24-11-13-9-16(34-2)19(32)17(10-13)35-3/h9-11,14,32H,4-8,12H2,1-3H3,(H2,23,27)(H,26,33)/b24-11+
InChIKey NILSOAWSHMLZJP-BHGWPJFGSA-N
Mol Weight 499.53 g/mol
Molecular Formula C22H29N9O5
Exact Mass 499.229165 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EPx3XBEf89A
Name 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(E)-(4-hydroxy-3,5-dimethoxyphenyl)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/C22H29N9O5/c1-30(14-7-5-4-6-8-14)12-15-18(25-29-31(15)21-20(23)27-36-28-21)22(33)26-24-11-13-9-16(34-2)19(32)17(10-13)35-3/h9-11,14,32H,4-8,12H2,1-3H3,(H2,23,27)(H,26,33)/b24-11+
InChIKey NILSOAWSHMLZJP-BHGWPJFGSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28083
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: D80310; Labnumber: NIG2-2194; SBI_ID: SBI-028087
Synonyms 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Temperature 318 °C