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6-Phenyl-4-(1-pyrrolidino)-3,5-diaza-thiopyran-2-one

View entire compound with spectra: 1 NMR

6-Phenyl-4-(1-pyrrolidino)-3,5-diaza-thiopyran-2-one
SpectraBase Compound ID BMSr5mZeuZc
InChI InChI=1S/C13H13N3OS/c17-13-15-12(16-8-4-5-9-16)14-11(18-13)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2
InChIKey PGQYBJQYOTUFFU-UHFFFAOYSA-N
Mol Weight 259.33 g/mol
Molecular Formula C13H13N3OS
Exact Mass 259.077933 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7NjtEpZaggy
Name 6-Phenyl-4-(1-pyrrolidino)-3,5-diaza-thiopyran-2-one
CAS Registry Number 63847-48-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H13N3OS
InChI InChI=1S/C13H13N3OS/c17-13-15-12(16-8-4-5-9-16)14-11(18-13)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2
InChIKey PGQYBJQYOTUFFU-UHFFFAOYSA-N
Instrument Name Bruker WP-200
Literature Reference E. Kleinpeter, R. Spitzner, W. Schroth, Magn. Res. Chem. 25, 688 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3