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 Google Search
Mol Weight	364.43 g/mol
Molecular Formula	C16H16N2O4S2
Exact Mass	364.055149 g/mol

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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