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

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2-amino-4-{3-[(4-fluorophenoxy)methyl]-2,4,6-trimethylphenyl}-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carbonitrile
SpectraBase Compound ID 9js2T2rV87G
InChI InChI=1S/C28H29FN2O3/c1-15-10-16(2)24(17(3)21(15)14-33-19-8-6-18(29)7-9-19)25-20(13-30)27(31)34-23-12-28(4,5)11-22(32)26(23)25/h6-10,25H,11-12,14,31H2,1-5H3
InChIKey JUJSASWECMKFLD-UHFFFAOYSA-N
Mol Weight 460.55 g/mol
Molecular Formula C28H29FN2O3
Exact Mass 460.216221 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9HzP8hBvBTm
Name 2-amino-4-{3-[(4-fluorophenoxy)methyl]-2,4,6-trimethylphenyl}-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/C28H29FN2O3/c1-15-10-16(2)24(17(3)21(15)14-33-19-8-6-18(29)7-9-19)25-20(13-30)27(31)34-23-12-28(4,5)11-22(32)26(23)25/h6-10,25H,11-12,14,31H2,1-5H3
InChIKey JUJSASWECMKFLD-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_8724
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent ACETONE-d6
Source File Reference VendorID: 1001912; UBI_ID: UBI-008727
Temperature 313 °C