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3-{p-[2-(diethylamino)ethoxy]phenyl}-2-methyl-4(3H)-quinazolinone, dihydrochloride, hydrate
SpectraBase Compound ID 7AzS35DcD5j
InChI InChI=1S/C21H25N3O2.2ClH.H2O/c1-4-23(5-2)14-15-26-18-12-10-17(11-13-18)24-16(3)22-20-9-7-6-8-19(20)21(24)25;;;/h6-13H,4-5,14-15H2,1-3H3;2*1H;1H2
InChIKey SJMAUQBYTTUSMO-UHFFFAOYSA-N
Mol Weight 442.39 g/mol
Molecular Formula C21H29Cl2N3O3
Exact Mass 441.158597 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9eG5reMjUub
Name 3-{p-[2-(diethylamino)ethoxy]phenyl}-2-methyl-4(3H)-quinazolinone, dihydrochloride, hydrate
Source of Sample Troponwerke, Koeln-Muelheim, Germany
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Formula C21H29Cl2N3O3
InChI InChI=1S/C21H25N3O2.2ClH.H2O/c1-4-23(5-2)14-15-26-18-12-10-17(11-13-18)24-16(3)22-20-9-7-6-8-19(20)21(24)25;;;/h6-13H,4-5,14-15H2,1-3H3;2*1H;1H2
InChIKey SJMAUQBYTTUSMO-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 3576M
Solvent TFA
Synonyms QUINAZOLINONE, 4/3H/-, 3-/P-/2- /DIETHYLAMINO/ETHOXY/PHENYL/-2-METHYL-, DIHYDROCHLORIDE, HYDRATE