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2-amino-4-{4-[(4-chlorobenzyl)oxy]-3-methoxyphenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
SpectraBase Compound ID 11l6H7vUQKv
InChI InChI=1S/C26H25ClN2O4/c1-26(2)11-19(30)24-22(12-26)33-25(29)18(13-28)23(24)16-6-9-20(21(10-16)31-3)32-14-15-4-7-17(27)8-5-15/h4-10,23H,11-12,14,29H2,1-3H3
InChIKey ZBWUOYVAHZMTNG-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 2tjyPUAjBXf
Name 2-amino-4-{4-[(4-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)18(13-28)23(24)16-6-9-20(21(10-16)31-3)32-14-15-4-7-17(27)8-5-15/h4-10,23H,11-12,14,29H2,1-3H3
InChIKey ZBWUOYVAHZMTNG-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12540
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/9122932; UBI_ID: UBI-012543
Temperature 313 °C