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propanoic acid, 3-[[2-[(2-carboxyethyl)thio]-6-phenyl-4-pyrimidinyl]thio]-
SpectraBase Compound ID 69A1ZlPDQef
InChI InChI=1S/C16H16N2O4S2/c19-14(20)6-8-23-13-10-12(11-4-2-1-3-5-11)17-16(18-13)24-9-7-15(21)22/h1-5,10H,6-9H2,(H,19,20)(H,21,22)
InChIKey NOZYFIMHMQGXEY-UHFFFAOYSA-N
Mol Weight 364.43 g/mol
Molecular Formula C16H16N2O4S2
Exact Mass 364.055149 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8DKwOIgtVsG
Name propanoic acid, 3-[[2-[(2-carboxyethyl)thio]-6-phenyl-4-pyrimidinyl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 364.055149347 u
Formula C16H16N2O4S2
InChI InChI=1S/C16H16N2O4S2/c19-14(20)6-8-23-13-10-12(11-4-2-1-3-5-11)17-16(18-13)24-9-7-15(21)22/h1-5,10H,6-9H2,(H,19,20)(H,21,22)
InChIKey NOZYFIMHMQGXEY-UHFFFAOYSA-N
Molecular Weight 364.434 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8761
Solvent DMSO-d6
Source Vendor ID: NMR/10230762; Lab Info: JSA; Lab Number: JSA-0000205