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2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 3-(3-chloro-4-methylphenyl)-3,4,7,8-tetrahydro-8-(3-nitrophenyl)-6-oxo-
SpectraBase Compound ID Kdpz0X1e1BC
InChI InChI=1S/C21H17ClN4O3S/c1-13-5-6-15(8-19(13)22)24-11-25-20(27)9-17(18(10-23)21(25)30-12-24)14-3-2-4-16(7-14)26(28)29/h2-8,17H,9,11-12H2,1H3
InChIKey IAIGNDGTJNEMKU-UHFFFAOYSA-N
Mol Weight 440.91 g/mol
Molecular Formula C21H17ClN4O3S
Exact Mass 440.070989 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 78yBI38JeEq
Name 2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 3-(3-chloro-4-methylphenyl)-3,4,7,8-tetrahydro-8-(3-nitrophenyl)-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 440.070989294 u
Formula C21H17ClN4O3S
InChI InChI=1S/C21H17ClN4O3S/c1-13-5-6-15(8-19(13)22)24-11-25-20(27)9-17(18(10-23)21(25)30-12-24)14-3-2-4-16(7-14)26(28)29/h2-8,17H,9,11-12H2,1H3
InChIKey IAIGNDGTJNEMKU-UHFFFAOYSA-N
Molecular Weight 440.905 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3488
Solvent DMSO-d6
Source Vendor ID: NMR/13278511