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3-(6-bromanyl-2-methyl-4-oxidanylidene-1H-quinolin-3-yl)propanoic acid

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-(6-bromanyl-2-methyl-4-oxidanylidene-1H-quinolin-3-yl)propanoic acid
SpectraBase Compound ID 8WwCGt7o153
InChI InChI=1S/C13H12BrNO3/c1-7-9(3-5-12(16)17)13(18)10-6-8(14)2-4-11(10)15-7/h2,4,6H,3,5H2,1H3,(H,15,18)(H,16,17)
InChIKey KUELJXSOAHJEBT-UHFFFAOYSA-N
Mol Weight 310.15 g/mol
Molecular Formula C13H12BrNO3
Exact Mass 309.000056 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3Sip6IbqDRP
Name 3-quinolinepropanoic acid, 6-bromo-4-hydroxy-2-methyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.000056247 u
Formula C13H12BrNO3
InChI InChI=1S/C13H12BrNO3/c1-7-9(3-5-12(16)17)13(18)10-6-8(14)2-4-11(10)15-7/h2,4,6H,3,5H2,1H3,(H,15,18)(H,16,17)
InChIKey KUELJXSOAHJEBT-UHFFFAOYSA-N
Molecular Weight 310.147 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5923
Solvent DMSO-d6
Source Vendor ID: NMR/9236246; Lab Info: DUR; Lab Number: DUR-AD00464