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2-amino-7,7-dimethyl-5-oxo-4-(5-{[3-(trifluoromethyl)phenoxy]methyl}-2-furyl)-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile

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2-amino-7,7-dimethyl-5-oxo-4-(5-{[3-(trifluoromethyl)phenoxy]methyl}-2-furyl)-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
SpectraBase Compound ID BtyMgHkkbgq
InChI InChI=1S/C24H21F3N2O4/c1-23(2)9-17(30)21-19(10-23)33-22(29)16(11-28)20(21)18-7-6-15(32-18)12-31-14-5-3-4-13(8-14)24(25,26)27/h3-8,20H,9-10,12,29H2,1-2H3
InChIKey WEQDSANWCKHYET-UHFFFAOYSA-N
Mol Weight 458.44 g/mol
Molecular Formula C24H21F3N2O4
Exact Mass 458.145342 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1bDyDi2F6kQ
Name 2-amino-7,7-dimethyl-5-oxo-4-(5-{[3-(trifluoromethyl)phenoxy]methyl}-2-furyl)-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/C24H21F3N2O4/c1-23(2)9-17(30)21-19(10-23)33-22(29)16(11-28)20(21)18-7-6-15(32-18)12-31-14-5-3-4-13(8-14)24(25,26)27/h3-8,20H,9-10,12,29H2,1-2H3
InChIKey WEQDSANWCKHYET-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_3084
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: 9314327; UBI_ID: UBI-003085
Temperature 315 °C