(4aR,9aS)-2-(t-Butyl)-10-[2'-(diethylamino)ethyl]-(octahydro)-acridine-maleate

SpectraBase Compound ID	IQoP10VsZQp
InChI	InChI=1S/C23H38N2.C4H4O4/c1-6-24(7-2)14-15-25-21-11-9-8-10-18(21)16-19-17-20(23(3,4)5)12-13-22(19)25;5-3(6)1-2-4(7)8/h8-11,19-20,22H,6-7,12-17H2,1-5H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t19-,20?,22-;/m1./s1
InChIKey	ALPLVXPOZSBNRE-IBYJSGIHSA-N Google Search
Mol Weight	458.6 g/mol
Molecular Formula	C27H42N2O4
Exact Mass	458.314458 g/mol

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SpectraBase Spectrum ID	3AM860ELmrH
Name	(4aR,9aS)-2-(t-Butyl)-10-[2'-(diethylamino)ethyl]-(octahydro)-acridine-maleate
Comments	Removed - unrepairable contamination (CH2Cl2)
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H42N2O4
InChI	InChI=1S/C23H38N2.C4H4O4/c1-6-24(7-2)14-15-25-21-11-9-8-10-18(21)16-19-17-20(23(3,4)5)12-13-22(19)25;5-3(6)1-2-4(7)8/h8-11,19-20,22H,6-7,12-17H2,1-5H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t19-,20?,22-;/m1./s1
InChIKey	ALPLVXPOZSBNRE-IBYJSGIHSA-N
Molecular Weight	458.643 g/mol
SMILES	OC(\C=C/C(=O)O)=O.[C@]12(N(c3c(C[C@@]2(CC(C(C)(C)C)CC1)[H])cccc3)CCN(CC)CC)[H]
SPLASH	splash10-000i-9000000000-597ee9f576b16a4eff85
Source of Spectrum	Y4-83-27-12
Synonyms	(2Z)-2-butenedioic acid compound with N-[2-((4aR,9aS)-2-tert-butyl-2,3,4,4a,9,9a-hexahydro-10(1H)-acridinyl)ethyl]-N,N-diethylamine (1:1) (trans)-2-(t-Butyl)-10-[2'-(diethylamino)ethyl]-(octahydro)-acridine-maleate
Wiley ID	1513449