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2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 3-(4-fluorophenyl)-3,4,7,8-tetrahydro-6-oxo-8-(2,4,5-trimethoxyphenyl)-

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2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 3-(4-fluorophenyl)-3,4,7,8-tetrahydro-6-oxo-8-(2,4,5-trimethoxyphenyl)-
SpectraBase Compound ID E5iCSU5S7tQ
InChI InChI=1S/C23H22FN3O4S/c1-29-19-10-21(31-3)20(30-2)8-17(19)16-9-22(28)27-12-26(13-32-23(27)18(16)11-25)15-6-4-14(24)5-7-15/h4-8,10,16H,9,12-13H2,1-3H3
InChIKey RYJMELHCUVTKKR-UHFFFAOYSA-N
Mol Weight 455.5 g/mol
Molecular Formula C23H22FN3O4S
Exact Mass 455.131506 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FcSLEaWqhpa
Name 2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 3-(4-fluorophenyl)-3,4,7,8-tetrahydro-6-oxo-8-(2,4,5-trimethoxyphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 455.131505533 u
Formula C23H22FN3O4S
InChI InChI=1S/C23H22FN3O4S/c1-29-19-10-21(31-3)20(30-2)8-17(19)16-9-22(28)27-12-26(13-32-23(27)18(16)11-25)15-6-4-14(24)5-7-15/h4-8,10,16H,9,12-13H2,1-3H3
InChIKey RYJMELHCUVTKKR-UHFFFAOYSA-N
Molecular Weight 455.504 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3653
Solvent DMSO-d6
Source Vendor ID: NMR/13278685