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ethyl 4-((7Z)-7-benzylidene-6-oxo-6,7-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl)benzoate
SpectraBase Compound ID I3oLBJYaVVy
InChI InChI=1S/C21H19N3O3S/c1-2-27-20(26)16-8-10-17(11-9-16)23-13-22-21-24(14-23)19(25)18(28-21)12-15-6-4-3-5-7-15/h3-12H,2,13-14H2,1H3/b18-12-
InChIKey SSMAYPDDAHMSIP-PDGQHHTCSA-N
Mol Weight 393.46 g/mol
Molecular Formula C21H19N3O3S
Exact Mass 393.114713 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 649bvqfsZV4
Name ethyl 4-((7Z)-7-benzylidene-6-oxo-6,7-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl)benzoate
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/C21H19N3O3S/c1-2-27-20(26)16-8-10-17(11-9-16)23-13-22-21-24(14-23)19(25)18(28-21)12-15-6-4-3-5-7-15/h3-12H,2,13-14H2,1H3/b18-12-
InChIKey SSMAYPDDAHMSIP-PDGQHHTCSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_859
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: C74928; Labnumber: RRKU-1739; SBI_ID: SBI-000861
Synonyms ethyl 4-(7-benzylidene-6-oxo-6,7-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl)benzoate
Temperature 308 °C