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

View entire compound with spectra: 1 NMR

2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 3-(4-bromophenyl)-3,4,7,8-tetrahydro-8-[4-(methylthio)phenyl]-6-oxo-
SpectraBase Compound ID 3ZdBV0Lb8YS
InChI InChI=1S/C21H18BrN3OS2/c1-27-17-8-2-14(3-9-17)18-10-20(26)25-12-24(13-28-21(25)19(18)11-23)16-6-4-15(22)5-7-16/h2-9,18H,10,12-13H2,1H3
InChIKey KOQVEDONWVUPFX-UHFFFAOYSA-N
Mol Weight 472.42 g/mol
Molecular Formula C21H18BrN3OS2
Exact Mass 471.007468 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 92uyDiMjGyH
Name 2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 3-(4-bromophenyl)-3,4,7,8-tetrahydro-8-[4-(methylthio)phenyl]-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 471.007467559 u
Formula C21H18BrN3OS2
InChI InChI=1S/C21H18BrN3OS2/c1-27-17-8-2-14(3-9-17)18-10-20(26)25-12-24(13-28-21(25)19(18)11-23)16-6-4-15(22)5-7-16/h2-9,18H,10,12-13H2,1H3
InChIKey KOQVEDONWVUPFX-UHFFFAOYSA-N
Molecular Weight 472.419 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3528
Solvent DMSO-d6
Source Vendor ID: NMR/13278552