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3-[(acetyloxy)methyl]-7-{[(1-methyl-4-nitro-1H-pyrazol-3-yl)carbonyl]amino}-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
SpectraBase Compound ID C3ZsgOIrZKz
InChI InChI=1S/C15H15N5O8S/c1-6(21)28-4-7-5-29-14-10(13(23)19(14)11(7)15(24)25)16-12(22)9-8(20(26)27)3-18(2)17-9/h3,10,14H,4-5H2,1-2H3,(H,16,22)(H,24,25)
InChIKey ZDWFTVRPWIBGJK-UHFFFAOYSA-N
Mol Weight 425.37 g/mol
Molecular Formula C15H15N5O8S
Exact Mass 425.064134 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 25skdN0tgR4
Name 3-[(acetyloxy)methyl]-7-{[(1-methyl-4-nitro-1H-pyrazol-3-yl)carbonyl]amino}-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/C15H15N5O8S/c1-6(21)28-4-7-5-29-14-10(13(23)19(14)11(7)15(24)25)16-12(22)9-8(20(26)27)3-18(2)17-9/h3,10,14H,4-5H2,1-2H3,(H,16,22)(H,24,25)
InChIKey ZDWFTVRPWIBGJK-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_21051
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/1027002; Labnumber: ZIL0020; UZI_ID: UZI-021059
Temperature 308 °C