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(4aS,9aR)-2-(t-Butyl)-10-[2'-(1'-pyrrolidinyl)ethyl]-(octahydro)-acridine-maleate
SpectraBase Compound ID Kekes9XPv4n
InChI InChI=1S/C23H36N2.C4H6O4/c1-23(2,3)20-10-11-22-19(17-20)16-18-8-4-5-9-21(18)25(22)15-14-24-12-6-7-13-24;5-3(6)1-2-4(7)8/h4-5,8-9,19-20,22H,6-7,10-17H2,1-3H3;1-2H2,(H,5,6)(H,7,8)/p-2/t19-,20?,22-;/m0./s1
InChIKey IEYXMJCBXKAXPI-CGCPRIJRSA-L
Mol Weight 456.6 g/mol
Molecular Formula C27H40N2O4
Exact Mass 456.298808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JdNJdAi5YXX
Name (4aS,9aR)-2-(t-Butyl)-10-[2'-(1'-pyrrolidinyl)ethyl]-(octahydro)-acridine-maleate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H40N2O4
InChI InChI=1S/C23H36N2.C4H6O4/c1-23(2,3)20-10-11-22-19(17-20)16-18-8-4-5-9-21(18)25(22)15-14-24-12-6-7-13-24;5-3(6)1-2-4(7)8/h4-5,8-9,19-20,22H,6-7,10-17H2,1-3H3;1-2H2,(H,5,6)(H,7,8)/p-2/t19-,20?,22-;/m0./s1
InChIKey IEYXMJCBXKAXPI-CGCPRIJRSA-L
Molecular Weight 456.627 g/mol
SMILES C([O-])(=O)CCC([O-])=O.[C@@]12(N(c3c(C[C@]2(CC(C(C)(C)C)CC1)[H])cccc3)CCN1CCCC1)[H]
SPLASH splash10-001i-9000000000-fcc65899035de37bf8e0
Source of Spectrum Y4-83-27-13
Synonyms (4aS,9aR)-2-tert-butyl-10-[2-(pyrrolidin-1-yl)ethyl]-1,2,3,4,4a,9,9a,10-octahydroacridine; butanedioate (trans)-2-(t-Butyl)-10-[2'-(1'-pyrrolidinyl)ethyl]-(octahydro)-acridine-maleate
Wiley ID 1513448