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2H-1,3-thiazine-6-carboxamide, 2-(1,3-benzodioxol-5-ylimino)-3-ethyltetrahydro-N-(4-iodophenyl)-4-oxo-, (2E)-

View entire compound with spectra: 1 NMR

2H-1,3-thiazine-6-carboxamide, 2-(1,3-benzodioxol-5-ylimino)-3-ethyltetrahydro-N-(4-iodophenyl)-4-oxo-, (2E)-
SpectraBase Compound ID ICk12ahdih4
InChI InChI=1S/C20H18IN3O4S/c1-2-24-18(25)10-17(19(26)22-13-5-3-12(21)4-6-13)29-20(24)23-14-7-8-15-16(9-14)28-11-27-15/h3-9,17H,2,10-11H2,1H3,(H,22,26)/b23-20+
InChIKey KKLLGKQEXSOYID-BSYVCWPDSA-N
Mol Weight 523.35 g/mol
Molecular Formula C20H18IN3O4S
Exact Mass 523.006272 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GV0NZyLESit
Name 2H-1,3-thiazine-6-carboxamide, 2-(1,3-benzodioxol-5-ylimino)-3-ethyltetrahydro-N-(4-iodophenyl)-4-oxo-, (2E)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 523.006272242 u
Formula C20H18IN3O4S
InChI InChI=1S/C20H18IN3O4S/c1-2-24-18(25)10-17(19(26)22-13-5-3-12(21)4-6-13)29-20(24)23-14-7-8-15-16(9-14)28-11-27-15/h3-9,17H,2,10-11H2,1H3,(H,22,26)/b23-20+
InChIKey KKLLGKQEXSOYID-BSYVCWPDSA-N
Molecular Weight 523.345 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_12954
Solvent DMSO-d6
Source Vendor ID: NMR/10222129; Lab Info: PE; Lab Number: PE-0002778