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7-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SpectraBase Compound ID KqNbpUA62EO
InChI InChI=1S/C14H15ClN4O4S/c1-3-18-10(7(15)4-16-18)11(20)17-8-12(21)19-9(14(22)23)6(2)5-24-13(8)19/h4,8,13H,3,5H2,1-2H3,(H,17,20)(H,22,23)
InChIKey QMQHXUBFNWSOKQ-UHFFFAOYSA-N
Mol Weight 370.81 g/mol
Molecular Formula C14H15ClN4O4S
Exact Mass 370.050254 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9U99NzXeQM7
Name 7-{[(4-chloro-1-ethyl-1H-pyrazol-5-yl)carbonyl]amino}-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
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/C14H15ClN4O4S/c1-3-18-10(7(15)4-16-18)11(20)17-8-12(21)19-9(14(22)23)6(2)5-24-13(8)19/h4,8,13H,3,5H2,1-2H3,(H,17,20)(H,22,23)
InChIKey QMQHXUBFNWSOKQ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_21081
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/1264388; Labnumber: ZIL0096; UZI_ID: UZI-021089
Temperature 308 °C