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2-amino-7,7-dimethyl-4-{4-[(4-methylbenzyl)oxy]-3-nitrophenyl}-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
SpectraBase Compound ID 7GtVhJ6Y2O6
InChI InChI=1S/C26H25N3O5/c1-15-4-6-16(7-5-15)14-33-21-9-8-17(10-19(21)29(31)32)23-18(13-27)25(28)34-22-12-26(2,3)11-20(30)24(22)23/h4-10,23H,11-12,14,28H2,1-3H3
InChIKey SWVFAZFGDUSADV-UHFFFAOYSA-N
Mol Weight 459.5 g/mol
Molecular Formula C26H25N3O5
Exact Mass 459.179421 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LdokdWbJL2s
Name 2-amino-7,7-dimethyl-4-{4-[(4-methylbenzyl)oxy]-3-nitrophenyl}-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/C26H25N3O5/c1-15-4-6-16(7-5-15)14-33-21-9-8-17(10-19(21)29(31)32)23-18(13-27)25(28)34-22-12-26(2,3)11-20(30)24(22)23/h4-10,23H,11-12,14,28H2,1-3H3
InChIKey SWVFAZFGDUSADV-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12739
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent CDCl3
Source File Reference VendorID: UZI/9125039; UBI_ID: UBI-012742
Temperature 313 °C