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4H-1-benzopyran-3-carbonitrile, 2-amino-4-[4-(benzoyloxy)phenyl]-5,6,7,8-tetrahydro-7,7-dimethyl-5-oxo-
SpectraBase Compound ID IqWg9nJECZD
InChI InChI=1S/C25H22N2O4/c1-25(2)12-19(28)22-20(13-25)31-23(27)18(14-26)21(22)15-8-10-17(11-9-15)30-24(29)16-6-4-3-5-7-16/h3-11,21H,12-13,27H2,1-2H3
InChIKey HYVFIXVDRPWKKU-UHFFFAOYSA-N
Mol Weight 414.46 g/mol
Molecular Formula C25H22N2O4
Exact Mass 414.157957 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID A6YduXRmLVh
Name 4H-1-benzopyran-3-carbonitrile, 2-amino-4-[4-(benzoyloxy)phenyl]-5,6,7,8-tetrahydro-7,7-dimethyl-5-oxo-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 414.157957192 u
Formula C25H22N2O4
InChI InChI=1S/C25H22N2O4/c1-25(2)12-19(28)22-20(13-25)31-23(27)18(14-26)21(22)15-8-10-17(11-9-15)30-24(29)16-6-4-3-5-7-16/h3-11,21H,12-13,27H2,1-2H3
InChIKey HYVFIXVDRPWKKU-UHFFFAOYSA-N
Molecular Weight 414.461 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5444
Solvent DMSO-d6
Source Vendor ID: NMR/9241537; Lab Info: L-19; Lab Number: L-19,Rozhkov