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{(2Z)-3-allyl-2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)imino]-4-oxo-1,3-thiazolidin-5-yl}acetic acid
SpectraBase Compound ID LUf7xNv2J2C
InChI InChI=1S/C19H20N4O4S/c1-4-10-22-17(26)14(11-15(24)25)28-19(22)20-16-12(2)21(3)23(18(16)27)13-8-6-5-7-9-13/h4-9,14H,1,10-11H2,2-3H3,(H,24,25)/b20-19-
InChIKey LCNIBYBYPDBZTE-VXPUYCOJSA-N
Mol Weight 400.45 g/mol
Molecular Formula C19H20N4O4S
Exact Mass 400.120526 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2UHF9RipCZn
Name {(2Z)-3-allyl-2-[(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)imino]-4-oxo-1,3-thiazolidin-5-yl}acetic acid
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 400.120526310 u
Formula C19H20N4O4S
InChI InChI=1S/C19H20N4O4S/c1-4-10-22-17(26)14(11-15(24)25)28-19(22)20-16-12(2)21(3)23(18(16)27)13-8-6-5-7-9-13/h4-9,14H,1,10-11H2,2-3H3,(H,24,25)/b20-19-
InChIKey LCNIBYBYPDBZTE-VXPUYCOJSA-N
Molecular Weight 400.453 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_460
Solvent DMSO-d6
Source Vendor ID: NMR/12268246