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(7Z)-3-(4-iodophenyl)-7-(3-nitrobenzylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
SpectraBase Compound ID 6PWdjeaSdZe
InChI InChI=1S/C18H13IN4O3S/c19-13-4-6-14(7-5-13)21-10-20-18-22(11-21)17(24)16(27-18)9-12-2-1-3-15(8-12)23(25)26/h1-9H,10-11H2/b16-9-
InChIKey HNNPURQRNJNMLG-SXGWCWSVSA-N
Mol Weight 492.29 g/mol
Molecular Formula C18H13IN4O3S
Exact Mass 491.975306 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7TLQ9oNjqNf
Name (7Z)-3-(4-iodophenyl)-7-(3-nitrobenzylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
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/C18H13IN4O3S/c19-13-4-6-14(7-5-13)21-10-20-18-22(11-21)17(24)16(27-18)9-12-2-1-3-15(8-12)23(25)26/h1-9H,10-11H2/b16-9-
InChIKey HNNPURQRNJNMLG-SXGWCWSVSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_1689
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: C98056; Labnumber: RRKU-1802; SBI_ID: SBI-001691
Synonyms 3-(4-iodophenyl)-7-(3-nitrobenzylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Temperature 315 °C