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6-bromo-3-{[(5-methyl-2-pyridinyl)amino]methyl}-1,3-benzoxazol-2(3H)-one
SpectraBase Compound ID 8xzylcdjUgo
InChI InChI=1S/C14H12BrN3O2/c1-9-2-5-13(16-7-9)17-8-18-11-4-3-10(15)6-12(11)20-14(18)19/h2-7H,8H2,1H3,(H,16,17)
InChIKey ITQYXUMXAKHERE-UHFFFAOYSA-N
Mol Weight 334.17 g/mol
Molecular Formula C14H12BrN3O2
Exact Mass 333.01129 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LvBgEHj1Thl
Name 6-bromo-3-{[(5-methyl-2-pyridinyl)amino]methyl}-1,3-benzoxazol-2(3H)-one
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/C14H12BrN3O2/c1-9-2-5-13(16-7-9)17-8-18-11-4-3-10(15)6-12(11)20-14(18)19/h2-7H,8H2,1H3,(H,16,17)
InChIKey ITQYXUMXAKHERE-UHFFFAOYSA-N
NMR Offset 12.8202
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_2639
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: ZI/6011393; Labnumber: NP-1558; IOH_ID: IOH-002640
Temperature 297 °C