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2-[2-(6,7-dimethoxy-4-quinazolinyl)ethyl]cyclohexane-1,3-dione
SpectraBase Compound ID AdDAEqsspUV
InChI InChI=1S/C18H20N2O4/c1-23-17-8-12-13(19-10-20-14(12)9-18(17)24-2)7-6-11-15(21)4-3-5-16(11)22/h8-11H,3-7H2,1-2H3
InChIKey FYOAHSRRYIIQMP-UHFFFAOYSA-N
Mol Weight 328.37 g/mol
Molecular Formula C18H20N2O4
Exact Mass 328.142307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AvMJsYNr9Pk
Name 2-[2-(6,7-dimethoxy-4-quinazolinyl)ethyl]cyclohexane-1,3-dione
Alternate Name(s) 2-[2-(6,7-dimethoxyquinazolin-4-yl)ethyl]cyclohexane-1,3-dione 2-[2-(6,7-dimethoxyquinazolin-4-yl)ethyl]cyclohexane-1,3-quinone
CAS Registry Number 76787-34-3
Comments Less than 3 mono-isotopic peaks
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Formula C18H20N2O4
InChI InChI=1S/C18H20N2O4/c1-23-17-8-12-13(19-10-20-14(12)9-18(17)24-2)7-6-11-15(21)4-3-5-16(11)22/h8-11H,3-7H2,1-2H3
InChIKey FYOAHSRRYIIQMP-UHFFFAOYSA-N
Molecular Weight 328.368 g/mol
SMILES c12c(cc(c(c2)OC)OC)ncnc1CCC1C(=O)CCCC1=O
SPLASH splash10-0udi-0090000000-75fad285c467b83d6545
Source of Spectrum Y-17-1492-0
Wiley ID 1326256