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2-amino-4-{4-[(2-chlorobenzyl)oxy]-3-methoxyphenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
SpectraBase Compound ID 9pOt6rmQwLl
InChI InChI=1S/C26H25ClN2O4/c1-26(2)11-19(30)24-22(12-26)33-25(29)17(13-28)23(24)15-8-9-20(21(10-15)31-3)32-14-16-6-4-5-7-18(16)27/h4-10,23H,11-12,14,29H2,1-3H3
InChIKey WGKYBYRSEBQIFJ-UHFFFAOYSA-N
Mol Weight 464.95 g/mol
Molecular Formula C26H25ClN2O4
Exact Mass 464.150285 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2iHyzOeSzX0
Name 2-amino-4-{4-[(2-chlorobenzyl)oxy]-3-methoxyphenyl}-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/C26H25ClN2O4/c1-26(2)11-19(30)24-22(12-26)33-25(29)17(13-28)23(24)15-8-9-20(21(10-15)31-3)32-14-16-6-4-5-7-18(16)27/h4-10,23H,11-12,14,29H2,1-3H3
InChIKey WGKYBYRSEBQIFJ-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12716
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/9124798; UBI_ID: UBI-012719
Temperature 308 °C