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1-(1-Cyano-1-mercaptomethyl-ethyl)-3,5-dimethyl-pyrimidine
SpectraBase Compound ID CnLkMgptAnL
InChI InChI=1S/C10H13N3S/c1-7-4-8(2)13-9(12-7)10(3,5-11)6-14/h4,14H,6H2,1-3H3
InChIKey XANQTFMIILYSMH-UHFFFAOYSA-N
Mol Weight 207.29 g/mol
Molecular Formula C10H13N3S
Exact Mass 207.083019 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JfjzRtooEwc
Name 1-(1-Cyano-1-mercaptomethyl-ethyl)-3,5-dimethyl-pyrimidine
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H13N3S
InChI InChI=1S/C10H13N3S/c1-7-4-8(2)13-9(12-7)10(3,5-11)6-14/h4,14H,6H2,1-3H3
InChIKey XANQTFMIILYSMH-UHFFFAOYSA-N
Instrument Name Jeol FX-100
Literature Reference T. Nishio, M. Fujisawa, Y. Omote, J. Chem. Soc. Perkin I 2523 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3