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3-{9-bromo-5-[4-(methylsulfanyl)phenyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-2-yl}phenyl methyl ether
SpectraBase Compound ID 835sUT3GWkT
InChI InChI=1S/C24H21BrN2O2S/c1-28-18-5-3-4-16(12-18)21-14-22-20-13-17(25)8-11-23(20)29-24(27(22)26-21)15-6-9-19(30-2)10-7-15/h3-13,22,24H,14H2,1-2H3
InChIKey ZUKVWTLADVZFMC-UHFFFAOYSA-N
Mol Weight 481.41 g/mol
Molecular Formula C24H21BrN2O2S
Exact Mass 480.050712 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E2JgaDtbNdo
Name 3-{9-bromo-5-[4-(methylsulfanyl)phenyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-2-yl}phenyl methyl ether
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C24H21BrN2O2S/c1-28-18-5-3-4-16(12-18)21-14-22-20-13-17(25)8-11-23(20)29-24(27(22)26-21)15-6-9-19(30-2)10-7-15/h3-13,22,24H,14H2,1-2H3
InChIKey ZUKVWTLADVZFMC-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_13643
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D88439; Labnumber: ExRud-03034; SBI_ID: SBI-013646
Synonyms 9-bromo-2-(3-methoxyphenyl)-5-[4-(methylsulfanyl)phenyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Temperature 300 °C