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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-bromophenyl)-3,4,7,8-tetrahydro-6-oxo-

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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-bromophenyl)-3,4,7,8-tetrahydro-6-oxo-
SpectraBase Compound ID KXThM3GU5w8
InChI InChI=1S/C21H17Br2N3O3S/c1-29-18-7-12(6-17(23)20(18)28)15-8-19(27)26-10-25(11-30-21(26)16(15)9-24)14-4-2-13(22)3-5-14/h2-7,15,28H,8,10-11H2,1H3
InChIKey DHFVKRIDDDOKAF-UHFFFAOYSA-N
Mol Weight 551.25 g/mol
Molecular Formula C21H17Br2N3O3S
Exact Mass 548.935739 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 69GcRr4fYMN
Name 2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 8-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-(4-bromophenyl)-3,4,7,8-tetrahydro-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 548.935738590 u
Formula C21H17Br2N3O3S
InChI InChI=1S/C21H17Br2N3O3S/c1-29-18-7-12(6-17(23)20(18)28)15-8-19(27)26-10-25(11-30-21(26)16(15)9-24)14-4-2-13(22)3-5-14/h2-7,15,28H,8,10-11H2,1H3
InChIKey DHFVKRIDDDOKAF-UHFFFAOYSA-N
Molecular Weight 551.253 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_3212
Solvent DMSO-d6
Source Vendor ID: NMR/13278391