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2-amino-4-{5-bromo-2-[(3-fluorobenzyl)oxy]phenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
SpectraBase Compound ID 9Racrt2IX8f
InChI InChI=1S/C23H18BrFN2O3/c24-14-7-8-19(29-12-13-3-1-4-15(25)9-13)16(10-14)21-17(11-26)23(27)30-20-6-2-5-18(28)22(20)21/h1,3-4,7-10,21H,2,5-6,12,27H2
InChIKey JVVSPJGWVFTIDS-UHFFFAOYSA-N
Mol Weight 469.31 g/mol
Molecular Formula C23H18BrFN2O3
Exact Mass 468.048484 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AMlam3ki7by
Name 2-amino-4-{5-bromo-2-[(3-fluorobenzyl)oxy]phenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
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/C23H18BrFN2O3/c24-14-7-8-19(29-12-13-3-1-4-15(25)9-13)16(10-14)21-17(11-26)23(27)30-20-6-2-5-18(28)22(20)21/h1,3-4,7-10,21H,2,5-6,12,27H2
InChIKey JVVSPJGWVFTIDS-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18306
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: UZI/1029298; Labnumber: TSI4115; UZI_ID: UZI-018313
Temperature 318 °C