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2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 3-(3-chloro-2-methylphenyl)-8-(3-fluorophenyl)-3,4,7,8-tetrahydro-6-oxo-
SpectraBase Compound ID FMhPYwcgNiP
InChI InChI=1S/C21H17ClFN3OS/c1-13-18(22)6-3-7-19(13)25-11-26-20(27)9-16(14-4-2-5-15(23)8-14)17(10-24)21(26)28-12-25/h2-8,16H,9,11-12H2,1H3
InChIKey WZFIRIPVJQVPOT-UHFFFAOYSA-N
Mol Weight 413.9 g/mol
Molecular Formula C21H17ClFN3OS
Exact Mass 413.076489 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IpXx7g6saSd
Name 2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 3-(3-chloro-2-methylphenyl)-8-(3-fluorophenyl)-3,4,7,8-tetrahydro-6-oxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 413.076489215 u
Formula C21H17ClFN3OS
InChI InChI=1S/C21H17ClFN3OS/c1-13-18(22)6-3-7-19(13)25-11-26-20(27)9-16(14-4-2-5-15(23)8-14)17(10-24)21(26)28-12-25/h2-8,16H,9,11-12H2,1H3
InChIKey WZFIRIPVJQVPOT-UHFFFAOYSA-N
Molecular Weight 413.898 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3677
Solvent DMSO-d6
Source Vendor ID: NMR/13278709