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2-isopropyl-4-methyl-3-phenyl-isocarbostyril
SpectraBase Compound ID 5ZiesZObeba
InChI InChI=1S/C19H19NO/c1-13(2)20-18(15-9-5-4-6-10-15)14(3)16-11-7-8-12-17(16)19(20)21/h4-13H,1-3H3
InChIKey PSKYVDVVGYILSA-UHFFFAOYSA-N
Mol Weight 277.37 g/mol
Molecular Formula C19H19NO
Exact Mass 277.146664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFsqZm7aaFr
Name 2-isopropyl-4-methyl-3-phenyl-isocarbostyril
Alternate Name(s) 2-isopropyl-4-methyl-3-phenyl-isoquinolin-1-one 4-methyl-3-phenyl-2-propan-2-yl-1-isoquinolinone 4-methyl-3-phenyl-2-propan-2-yl-isoquinolin-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C19H19NO
InChI InChI=1S/C19H19NO/c1-13(2)20-18(15-9-5-4-6-10-15)14(3)16-11-7-8-12-17(16)19(20)21/h4-13H,1-3H3
InChIKey PSKYVDVVGYILSA-UHFFFAOYSA-N
Molecular Weight 277.367 g/mol
SMILES C=1(N(C(c2c(C1C)cccc2)=O)C(C)C)c1ccccc1
SPLASH splash10-003i-0090000000-b75c07f23d4e381c740c
Source of Spectrum J-58-3117-15
Wiley ID 1281254