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2-(methylsulfanyl)ethyl [4-((E)-{[(4-chloro-1-methyl-1H-pyrazol-5-yl)carbonyl]hydrazono}methyl)phenoxy]acetate
SpectraBase Compound ID B0vR4j87seM
InChI InChI=1S/C17H19ClN4O4S/c1-22-16(14(18)10-20-22)17(24)21-19-9-12-3-5-13(6-4-12)26-11-15(23)25-7-8-27-2/h3-6,9-10H,7-8,11H2,1-2H3,(H,21,24)/b19-9+
InChIKey BBHRVSYBSZGKHJ-DJKKODMXSA-N
Mol Weight 410.88 g/mol
Molecular Formula C17H19ClN4O4S
Exact Mass 410.081554 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GQJMiPuLcNk
Name 2-(methylsulfanyl)ethyl [4-((E)-{[(4-chloro-1-methyl-1H-pyrazol-5-yl)carbonyl]hydrazono}methyl)phenoxy]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/C17H19ClN4O4S/c1-22-16(14(18)10-20-22)17(24)21-19-9-12-3-5-13(6-4-12)26-11-15(23)25-7-8-27-2/h3-6,9-10H,7-8,11H2,1-2H3,(H,21,24)/b19-9+
InChIKey BBHRVSYBSZGKHJ-DJKKODMXSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13063
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: UZI/9034583; UBI_ID: UBI-013066
Synonyms 2-(methylsulfanyl)ethyl [4-({[(4-chloro-1-methyl-1H-pyrazol-5-yl)carbonyl]hydrazono}methyl)phenoxy]acetate
Temperature 308 °C