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2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 8-(3-bromo-4-hydroxy-5-methoxyphenyl)-3,4,7,8-tetrahydro-3-(4-methylphenyl)-6-oxo-
SpectraBase Compound ID Fx6wbDJX7CW
InChI InChI=1S/C22H20BrN3O3S/c1-13-3-5-15(6-4-13)25-11-26-20(27)9-16(17(10-24)22(26)30-12-25)14-7-18(23)21(28)19(8-14)29-2/h3-8,16,28H,9,11-12H2,1-2H3
InChIKey DYVCHZRMKJHUIC-UHFFFAOYSA-N
Mol Weight 486.38 g/mol
Molecular Formula C22H20BrN3O3S
Exact Mass 485.040876 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9amH2vUeBKv
Name 2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 8-(3-bromo-4-hydroxy-5-methoxyphenyl)-3,4,7,8-tetrahydro-3-(4-methylphenyl)-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 485.040875687 u
Formula C22H20BrN3O3S
InChI InChI=1S/C22H20BrN3O3S/c1-13-3-5-15(6-4-13)25-11-26-20(27)9-16(17(10-24)22(26)30-12-25)14-7-18(23)21(28)19(8-14)29-2/h3-8,16,28H,9,11-12H2,1-2H3
InChIKey DYVCHZRMKJHUIC-UHFFFAOYSA-N
Molecular Weight 486.384 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3153
Solvent DMSO-d6
Source Vendor ID: NMR/13278331