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(8E)-2-amino-8-(3-chlorobenzylidene)-4-(3-chlorophenyl)-6-isopropyl-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile

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(8E)-2-amino-8-(3-chlorobenzylidene)-4-(3-chlorophenyl)-6-isopropyl-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
SpectraBase Compound ID CPVqfLGSgD2
InChI InChI=1S/C25H23Cl2N3O/c1-15(2)30-13-18(9-16-5-3-7-19(26)10-16)24-22(14-30)23(21(12-28)25(29)31-24)17-6-4-8-20(27)11-17/h3-11,15,23H,13-14,29H2,1-2H3/b18-9+
InChIKey XMKIULFQILPFQK-GIJQJNRQSA-N
Mol Weight 452.39 g/mol
Molecular Formula C25H23Cl2N3O
Exact Mass 451.121818 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5gkLsjSFIFS
Name (8E)-2-amino-8-(3-chlorobenzylidene)-4-(3-chlorophenyl)-6-isopropyl-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-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/C25H23Cl2N3O/c1-15(2)30-13-18(9-16-5-3-7-19(26)10-16)24-22(14-30)23(21(12-28)25(29)31-24)17-6-4-8-20(27)11-17/h3-11,15,23H,13-14,29H2,1-2H3/b18-9+
InChIKey XMKIULFQILPFQK-GIJQJNRQSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_15638
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: UZI/7131289; UBI_ID: UBI-015641
Synonyms 2-amino-8-(3-chlorobenzylidene)-4-(3-chlorophenyl)-6-isopropyl-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Temperature 308 °C