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2-amino-4-{2-[(2-chlorobenzyl)oxy]phenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
SpectraBase Compound ID 20zQRXkQqDY
InChI InChI=1S/C25H23ClN2O3/c1-25(2)11-19(29)23-21(12-25)31-24(28)17(13-27)22(23)16-8-4-6-10-20(16)30-14-15-7-3-5-9-18(15)26/h3-10,22H,11-12,14,28H2,1-2H3
InChIKey QPWZFRHRFBMOTL-UHFFFAOYSA-N
Mol Weight 434.92 g/mol
Molecular Formula C25H23ClN2O3
Exact Mass 434.13972 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KyO9VoK2Ov
Name 2-amino-4-{2-[(2-chlorobenzyl)oxy]phenyl}-7,7-dimethyl-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/C25H23ClN2O3/c1-25(2)11-19(29)23-21(12-25)31-24(28)17(13-27)22(23)16-8-4-6-10-20(16)30-14-15-7-3-5-9-18(15)26/h3-10,22H,11-12,14,28H2,1-2H3
InChIKey QPWZFRHRFBMOTL-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_1018
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/8159548; Labnumber: TSH-8100032
Temperature 303 °C