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2-(3-BENZYLTETRAHYDRO-2H-1,3-THIAZIN-2-YLIDENE)-4-NITROPHENYLACETONITRILE
SpectraBase Compound ID EzuRBU4YvVY
InChI InChI=1S/C19H17N3O2S/c20-13-18(16-7-9-17(10-8-16)22(23)24)19-21(11-4-12-25-19)14-15-5-2-1-3-6-15/h1-3,5-10H,4,11-12,14H2/b19-18-
InChIKey IJPSBWXSMLCYKH-HNENSFHCSA-N
Mol Weight 351.42 g/mol
Molecular Formula C19H17N3O2S
Exact Mass 351.104148 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 46tcJZHhBUg
Name 2-(3-BENZYLTETRAHYDRO-2H-1,3-THIAZIN-2-YLIDENE)-4-NITROPHENYLACETONITRILE
Compound Number 13B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H17N3O2S
InChI InChI=1S/C19H17N3O2S/c20-13-18(16-7-9-17(10-8-16)22(23)24)19-21(11-4-12-25-19)14-15-5-2-1-3-6-15/h1-3,5-10H,4,11-12,14H2/b19-18-
InChIKey IJPSBWXSMLCYKH-HNENSFHCSA-N
Literature Reference Author W.HANEFELD,H.HARMS
Literature Reference Citation J.HETCYCL.CHEM.,35,49(1998)
Literature Reference DOI 10.1002/jhet.5570350110
Molecular Weight 351.423 g/mol
Solvent CDCl3
Source File Reference UWCS25228