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acetic acid, [(2,3,4,5-tetrahydro-3,5-dioxo-1,2,4-triazin-6-yl)thio]-, 4-fluorophenyl ester
SpectraBase Compound ID LJFzAZbwB4M
InChI InChI=1S/C11H8FN3O4S/c12-6-1-3-7(4-2-6)19-8(16)5-20-10-9(17)13-11(18)15-14-10/h1-4H,5H2,(H2,13,15,17,18)
InChIKey QZKDMLBECSGVNX-UHFFFAOYSA-N
Mol Weight 297.26 g/mol
Molecular Formula C11H8FN3O4S
Exact Mass 297.021955 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7ni5SAYrCYY
Name acetic acid, [(2,3,4,5-tetrahydro-3,5-dioxo-1,2,4-triazin-6-yl)thio]-, 4-fluorophenyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 297.021955083 u
Formula C11H8FN3O4S
InChI InChI=1S/C11H8FN3O4S/c12-6-1-3-7(4-2-6)19-8(16)5-20-10-9(17)13-11(18)15-14-10/h1-4H,5H2,(H2,13,15,17,18)
InChIKey QZKDMLBECSGVNX-UHFFFAOYSA-N
Molecular Weight 297.260 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_9048
Solvent DMSO-d6
Source Vendor ID: NMR/14228229