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2-Benzylidene-7-(4'-nitrobenzylidene)-9-butyl-2,3,5,6,7,8-hexahydro-4H-acridin-1-one
SpectraBase Compound ID 4VkQe21xav5
InChI InChI=1S/C31H30N2O3/c1-2-3-9-26-27-20-23(18-22-10-14-25(15-11-22)33(35)36)12-16-28(27)32-29-17-13-24(31(34)30(26)29)19-21-7-5-4-6-8-21/h4-8,10-11,14-15,18-19H,2-3,9,12-13,16-17,20H2,1H3/b23-18+,24-19+
InChIKey FKMUGUZGIRPPLR-KBQFLUNPSA-N
Mol Weight 478.59 g/mol
Molecular Formula C31H30N2O3
Exact Mass 478.225643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AXWrZUnNxeE
Name 2-Benzylidene-7-(4'-nitrobenzylidene)-9-butyl-2,3,5,6,7,8-hexahydro-4H-acridin-1-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H30N2O3
InChI InChI=1S/C31H30N2O3/c1-2-3-9-26-27-20-23(18-22-10-14-25(15-11-22)33(35)36)12-16-28(27)32-29-17-13-24(31(34)30(26)29)19-21-7-5-4-6-8-21/h4-8,10-11,14-15,18-19H,2-3,9,12-13,16-17,20H2,1H3/b23-18+,24-19+
InChIKey FKMUGUZGIRPPLR-KBQFLUNPSA-N
Molecular Weight 478.592 g/mol
SMILES c12c(c3C\C(=C\c4ccc(N(=O)=O)cc4)CCc3nc1CC\C(C2=O)=C/c1ccccc1)CCCC
SPLASH splash10-004l-6000900000-888e75f6f65e5202c738
Source of Spectrum D1-1996-81-5
Wiley ID 834806