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3-[3-(4,4-Dimethy-4,5-dihydrooxazol-2-yl)phenyl]-2-methyl-1(2H)-isoquinolone
SpectraBase Compound ID K1Tc7uKleNU
InChI InChI=1S/C21H20N2O2/c1-21(2)13-25-19(22-21)16-9-6-8-15(11-16)18-12-14-7-4-5-10-17(14)20(24)23(18)3/h4-12H,13H2,1-3H3
InChIKey VOOAJWCJNBKRPK-UHFFFAOYSA-N
Mol Weight 332.4 g/mol
Molecular Formula C21H20N2O2
Exact Mass 332.152478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Oty13VT50p
Name 3-[3-(4,4-Dimethy-4,5-dihydrooxazol-2-yl)phenyl]-2-methyl-1(2H)-isoquinolone
Comments Less than 3 mono-isotopic peaks
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Formula C21H20N2O2
InChI InChI=1S/C21H20N2O2/c1-21(2)13-25-19(22-21)16-9-6-8-15(11-16)18-12-14-7-4-5-10-17(14)20(24)23(18)3/h4-12H,13H2,1-3H3
InChIKey VOOAJWCJNBKRPK-UHFFFAOYSA-N
Molecular Weight 332.403 g/mol
SMILES C=1(N(C(c2c(C1)cccc2)=O)C)c1cc(C2=NC(C)(C)CO2)ccc1
SPLASH splash10-001i-0009000000-d940fa5a974e1de8b649
Source of Spectrum KC-0-475-1
Synonyms 3-[3-(4,4-dimethyl-4,5-dihydro-1,3-oxazol-2-yl)phenyl]-2-methyl-1(2H)-isoquinolinone 3-[3-(4,4-dimethyl-5H-oxazol-2-yl)phenyl]-2-methyl-1-isoquinolinone 3-[3-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-2-methylisoquinolin-1-one 3-[3-(4,4-dimethyl-5H-oxazol-2-yl)phenyl]-2-methyl-isoquinolin-1-one 3-[3-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]-2-methyl-isoquinolin-1-one
Wiley ID 787323