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(5-{[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-tetraazol-1-yl)acetic acid
SpectraBase Compound ID GntABdawYhs
InChI InChI=1S/C11H10FN5O3S/c12-7-3-1-2-4-8(7)13-9(18)6-21-11-14-15-16-17(11)5-10(19)20/h1-4H,5-6H2,(H,13,18)(H,19,20)
InChIKey GMOOGBOSGFLQEY-UHFFFAOYSA-N
Mol Weight 311.29 g/mol
Molecular Formula C11H10FN5O3S
Exact Mass 311.048839 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Enm2W11auXw
Name (5-{[2-(2-fluoroanilino)-2-oxoethyl]sulfanyl}-1H-tetraazol-1-yl)acetic 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/C11H10FN5O3S/c12-7-3-1-2-4-8(7)13-9(18)6-21-11-14-15-16-17(11)5-10(19)20/h1-4H,5-6H2,(H,13,18)(H,19,20)
InChIKey GMOOGBOSGFLQEY-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_2834
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: D04888; Labnumber: MVERET-0928; SBI_ID: SBI-002836
Temperature 318 °C