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4-pyrimidinecarboxamide, 5-chloro-N-[(4-methylphenyl)methyl]-2-(methylthio)-
SpectraBase Compound ID AlLR9x2Cxly
InChI InChI=1S/C14H14ClN3OS/c1-9-3-5-10(6-4-9)7-16-13(19)12-11(15)8-17-14(18-12)20-2/h3-6,8H,7H2,1-2H3,(H,16,19)
InChIKey ILFRITVAVLHJRR-UHFFFAOYSA-N
Mol Weight 307.8 g/mol
Molecular Formula C14H14ClN3OS
Exact Mass 307.054611 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Eb0C2OufZxg
Name 4-pyrimidinecarboxamide, 5-chloro-N-[(4-methylphenyl)methyl]-2-(methylthio)-
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/C14H14ClN3OS/c1-9-3-5-10(6-4-9)7-16-13(19)12-11(15)8-17-14(18-12)20-2/h3-6,8H,7H2,1-2H3,(H,16,19)
InChIKey ILFRITVAVLHJRR-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_488
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: F04227; Labnumber: GOR-S1139-0010