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5-pyrimidinecarboxylic acid, 1,6-dihydro-1,4-dimethyl-2-(methylthio)-6-phenyl-, ethyl ester
SpectraBase Compound ID 8Dq1psWnkv1
InChI InChI=1S/C16H20N2O2S/c1-5-20-15(19)13-11(2)17-16(21-4)18(3)14(13)12-9-7-6-8-10-12/h6-10,14H,5H2,1-4H3
InChIKey KSKFCUCXECAMKZ-UHFFFAOYSA-N
Mol Weight 304.41 g/mol
Molecular Formula C16H20N2O2S
Exact Mass 304.124549 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BUU4oBad7XR
Name 5-pyrimidinecarboxylic acid, 1,6-dihydro-1,4-dimethyl-2-(methylthio)-6-phenyl-, ethyl 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 304.124549064 u
Formula C16H20N2O2S
InChI InChI=1S/C16H20N2O2S/c1-5-20-15(19)13-11(2)17-16(21-4)18(3)14(13)12-9-7-6-8-10-12/h6-10,14H,5H2,1-4H3
InChIKey KSKFCUCXECAMKZ-UHFFFAOYSA-N
Molecular Weight 304.408 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_3169
Solvent DMSO-d6
Source Vendor ID: NMR/9258585; Lab Info: *0231632*; Lab Number: BAS 0231632
Temperature 29.85 °C