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2-amino-4-[4-(2-amino-3-cyano-5-oxo-4,6,7,8-tetrahydrochromen-4-yl)phenyl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile 2-amino-4-[4-(2-amino-3-cyano-5-keto-4,6,7,8-tetrahydrochromen-4-yl)phenyl]-5-keto-4,6,7,8-tetrahydrochromene-3-carbonitrile
SpectraBase Compound ID CXG3nYMdo85
InChI InChI=1S/C26H22N4O4/c27-11-15-21(23-17(31)3-1-5-19(23)33-25(15)29)13-7-9-14(10-8-13)22-16(12-28)26(30)34-20-6-2-4-18(32)24(20)22/h7-10,21-22H,1-6,29-30H2
InChIKey HKWGHICAKOLXTP-UHFFFAOYSA-N
Mol Weight 454.49 g/mol
Molecular Formula C26H22N4O4
Exact Mass 454.164105 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CJjjfGa4Azb
Name 2-amino-4-[4-(2-amino-3-cyano-5-oxo-4,6,7,8-tetrahydrochromen-4-yl)phenyl]-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile 2-amino-4-[4-(2-amino-3-cyano-5-keto-4,6,7,8-tetrahydrochromen-4-yl)phenyl]-5-keto-4,6,7,8-tetrahydrochromene-3-carbonitrile
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 454.164105200 u
Formula C26H22N4O4
InChI InChI=1S/C26H22N4O4/c27-11-15-21(23-17(31)3-1-5-19(23)33-25(15)29)13-7-9-14(10-8-13)22-16(12-28)26(30)34-20-6-2-4-18(32)24(20)22/h7-10,21-22H,1-6,29-30H2
InChIKey HKWGHICAKOLXTP-UHFFFAOYSA-N
Molecular Weight 454.486 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5278
Solvent DMSO-d6
Source Vendor ID: NMR/9251109; Lab Info: L-19; Lab Number: L-19,Rozhkov