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1,2,3,4,5,6-Hexahydro-3-methyl-1-phenyl-5,10-dioxobenzo[h]quinazolinium-3-perchlorate
SpectraBase Compound ID FlQmoV3iUJ8
InChI InChI=1S/C19H16N2O2.ClHO4/c1-20-11-16-17(21(12-20)13-7-3-2-4-8-13)19(23)15-10-6-5-9-14(15)18(16)22;2-1(3,4)5/h2-10H,11-12H2,1H3;(H,2,3,4,5)
InChIKey QUTIUDULTKGDCD-UHFFFAOYSA-N
Mol Weight 404.81 g/mol
Molecular Formula C19H17ClN2O6
Exact Mass 404.077514 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cndx53fO86M
Name 1,2,3,4,5,6-Hexahydro-3-methyl-1-phenyl-5,10-dioxobenzo[h]quinazolinium-3-perchlorate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17ClN2O6
InChI InChI=1S/C19H16N2O2.ClHO4/c1-20-11-16-17(21(12-20)13-7-3-2-4-8-13)19(23)15-10-6-5-9-14(15)18(16)22;2-1(3,4)5/h2-10H,11-12H2,1H3;(H,2,3,4,5)
InChIKey QUTIUDULTKGDCD-UHFFFAOYSA-N
Molecular Weight 404.806 g/mol
SMILES [Cl]([O-])(=O)(=O)=O.C12=C(C(=O)c3c(C2=O)cccc3)C[NH+](CN1c1ccccc1)C
SPLASH splash10-01vk-9000000000-a471ff44054d133032b9
Source of Spectrum D8-324-170-41
Wiley ID 1514004