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4H-1-benzopyran-3-carbonitrile, 2-amino-5,6,7,8-tetrahydro-5-oxo-4-[4-(trifluoromethyl)phenyl]-
SpectraBase Compound ID 24fIh4FRLZb
InChI InChI=1S/C17H13F3N2O2/c18-17(19,20)10-6-4-9(5-7-10)14-11(8-21)16(22)24-13-3-1-2-12(23)15(13)14/h4-7,14H,1-3,22H2
InChIKey XKYXFKAQXPAKJO-UHFFFAOYSA-N
Mol Weight 334.3 g/mol
Molecular Formula C17H13F3N2O2
Exact Mass 334.092912 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K58h20ylZo2
Name 4H-1-benzopyran-3-carbonitrile, 2-amino-5,6,7,8-tetrahydro-5-oxo-4-[4-(trifluoromethyl)phenyl]-
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/C17H13F3N2O2/c18-17(19,20)10-6-4-9(5-7-10)14-11(8-21)16(22)24-13-3-1-2-12(23)15(13)14/h4-7,14H,1-3,22H2
InChIKey XKYXFKAQXPAKJO-UHFFFAOYSA-N
NMR Offset 16.0087
NMR Spectrometer Frequency 500.133
Observed nucleus 1H
Origin 1H_ASIOH_8516_6838
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: TSH/5636896; IOH_ID: IOH-013842