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(8E)-8-(4-(benzyloxy)benzylidene)-2-amino-4-(4-(benzyloxy)phenyl)-5,6,7,8-tetrahydro-6-methyl-4H-pyrano [3,2-c]pyridine-3-carbonitrile
SpectraBase Compound ID 7Xw23r8n2D3
InChI InChI=1S/C37H33N3O3/c1-40-22-30(20-26-12-16-31(17-13-26)41-24-27-8-4-2-5-9-27)36-34(23-40)35(33(21-38)37(39)43-36)29-14-18-32(19-15-29)42-25-28-10-6-3-7-11-28/h2-20,35H,22-25,39H2,1H3/b30-20+
InChIKey QDBAXUPUDJSJAK-TWKHWXDSSA-N
Mol Weight 567.7 g/mol
Molecular Formula C37H33N3O3
Exact Mass 567.252192 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1DLONPqRyua
Name (8E)-8-(4-(benzyloxy)benzylidene)-2-amino-4-(4-(benzyloxy)phenyl)-5,6,7,8-tetrahydro-6-methyl-4H-pyrano [3,2-c]pyridine-3-carbonitrile
Alternate Name(s) (E)-2-amino-8-(4-(benzyloxy)benzylidene)-4-(4-(benzyloxy)phenyl)-6-methyl-5,6,7,8-tetrahydro-4H-pyrano[3,2-c]pyridine-3-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H33N3O3
InChI InChI=1S/C37H33N3O3/c1-40-22-30(20-26-12-16-31(17-13-26)41-24-27-8-4-2-5-9-27)36-34(23-40)35(33(21-38)37(39)43-36)29-14-18-32(19-15-29)42-25-28-10-6-3-7-11-28/h2-20,35H,22-25,39H2,1H3/b30-20+
InChIKey QDBAXUPUDJSJAK-TWKHWXDSSA-N
Literature Reference DOI 10.1002/jccs.201100667
Molecular Weight 567.689 g/mol
SMILES NC1=C(C(C=2CN(C\C(C2O1)=C/c1ccc(cc1)OCc1ccccc1)C)c1ccc(cc1)OCc1ccccc1)C#N
SPLASH splash10-0ul3-9544450000-e845d2c7cce50c295f20
Source of Spectrum QA-59-870-5b
Wiley ID 1791260