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2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 3-(3-chloro-2-methylphenyl)-3,4,7,8-tetrahydro-8-(4-hydroxy-3-methoxyphenyl)-6-oxo-
SpectraBase Compound ID B8StKIHdJuE
InChI InChI=1S/C22H20ClN3O3S/c1-13-17(23)4-3-5-18(13)25-11-26-21(28)9-15(16(10-24)22(26)30-12-25)14-6-7-19(27)20(8-14)29-2/h3-8,15,27H,9,11-12H2,1-2H3
InChIKey QHVQOSHGEAZMOV-UHFFFAOYSA-N
Mol Weight 441.93 g/mol
Molecular Formula C22H20ClN3O3S
Exact Mass 441.09139 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2f1EGP95IWG
Name 2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 3-(3-chloro-2-methylphenyl)-3,4,7,8-tetrahydro-8-(4-hydroxy-3-methoxyphenyl)-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 441.091390387 u
Formula C22H20ClN3O3S
InChI InChI=1S/C22H20ClN3O3S/c1-13-17(23)4-3-5-18(13)25-11-26-21(28)9-15(16(10-24)22(26)30-12-25)14-6-7-19(27)20(8-14)29-2/h3-8,15,27H,9,11-12H2,1-2H3
InChIKey QHVQOSHGEAZMOV-UHFFFAOYSA-N
Molecular Weight 441.933 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3460
Solvent DMSO-d6
Source Vendor ID: NMR/13278481