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1-Benzyl-1,2,3,4,5,6-hexahydro-3,3-diethyl-5,6-dioxo-benzo[h]quinazolinium - perchlorate
SpectraBase Compound ID D8Bu9YVqvWm
InChI InChI=1S/C23H25N2O2.ClHO4/c1-3-25(4-2)15-20-21(24(16-25)14-17-10-6-5-7-11-17)18-12-8-9-13-19(18)22(26)23(20)27;2-1(3,4)5/h5-13H,3-4,14-16H2,1-2H3;(H,2,3,4,5)/q+1;/p-1
InChIKey BYIYTJINNLWPQD-UHFFFAOYSA-M
Mol Weight 460.91 g/mol
Molecular Formula C23H25ClN2O6
Exact Mass 460.140114 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2DfjCmy6AS
Name 1-Benzyl-1,2,3,4,5,6-hexahydro-3,3-diethyl-5,6-dioxo-benzo[h]quinazolinium - perchlorate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H25ClN2O6
InChI InChI=1S/C23H25N2O2.ClHO4/c1-3-25(4-2)15-20-21(24(16-25)14-17-10-6-5-7-11-17)18-12-8-9-13-19(18)22(26)23(20)27;2-1(3,4)5/h5-13H,3-4,14-16H2,1-2H3;(H,2,3,4,5)/q+1;/p-1
InChIKey BYIYTJINNLWPQD-UHFFFAOYSA-M
Molecular Weight 460.914 g/mol
SMILES [Cl]([O-])(=O)(=O)=O.C12=C(N(C[N+](C2)(CC)CC)Cc2ccccc2)c2ccccc2C(C1=O)=O
SPLASH splash10-0a4l-9300000000-47fade7890f70d57f2fb
Source of Spectrum D8-324-95-17
Synonyms 1-Benzyl-3,3-diethyl-5,6-dioxo-1,2,3,4,5,6-hexahydrobenzo[h]quinazolin-3-ium perchlorate
Wiley ID 1513981