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2-[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]propanoic acid
SpectraBase Compound ID 1WU2TdooRwv
InChI InChI=1S/C9H12N2O2S/c1-5-4-6(2)11-9(10-5)14-7(3)8(12)13/h4,7H,1-3H3,(H,12,13)
InChIKey OFYICVNRPJIHRH-UHFFFAOYSA-N
Mol Weight 212.27 g/mol
Molecular Formula C9H12N2O2S
Exact Mass 212.061949 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5e9zgRcs2P8
Name 2-[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]propanoic 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/C9H12N2O2S/c1-5-4-6(2)11-9(10-5)14-7(3)8(12)13/h4,7H,1-3H3,(H,12,13)
InChIKey OFYICVNRPJIHRH-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3534
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: 9316025; UBI_ID: UBI-003535
Temperature 308 °C