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4-(1-Cyano-1-mercaptomethyl-ethyl)-2-phenyl-5,6,7,8-tetrahydro-quinazoline

View entire compound with spectra: 1 NMR

4-(1-Cyano-1-mercaptomethyl-ethyl)-2-phenyl-5,6,7,8-tetrahydro-quinazoline
SpectraBase Compound ID HfsVK5yTGkU
InChI InChI=1S/C18H19N3S/c1-18(11-19,12-22)16-14-9-5-6-10-15(14)20-17(21-16)13-7-3-2-4-8-13/h2-4,7-8,22H,5-6,9-10,12H2,1H3
InChIKey FPQPUHQOCLKPFO-UHFFFAOYSA-N
Mol Weight 309.43 g/mol
Molecular Formula C18H19N3S
Exact Mass 309.129969 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FqjThRd428O
Name 4-(1-Cyano-1-mercaptomethyl-ethyl)-2-phenyl-5,6,7,8-tetrahydro-quinazoline
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H19N3S
InChI InChI=1S/C18H19N3S/c1-18(11-19,12-22)16-14-9-5-6-10-15(14)20-17(21-16)13-7-3-2-4-8-13/h2-4,7-8,22H,5-6,9-10,12H2,1H3
InChIKey FPQPUHQOCLKPFO-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