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2-isopropyl-3-phenyl-isocarbostyril
SpectraBase Compound ID 8Z06IcsK48M
InChI InChI=1S/C18H17NO/c1-13(2)19-17(14-8-4-3-5-9-14)12-15-10-6-7-11-16(15)18(19)20/h3-13H,1-2H3
InChIKey PNKYIUKLSZSRPA-UHFFFAOYSA-N
Mol Weight 263.34 g/mol
Molecular Formula C18H17NO
Exact Mass 263.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BVFaqt61Z3T
Name 2-isopropyl-3-phenyl-isocarbostyril
Alternate Name(s) 2-isopropyl-3-phenyl-isoquinolin-1-one 3-phenyl-2-propan-2-yl-1-isoquinolinone 3-phenyl-2-propan-2-yl-isoquinolin-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C18H17NO
InChI InChI=1S/C18H17NO/c1-13(2)19-17(14-8-4-3-5-9-14)12-15-10-6-7-11-16(15)18(19)20/h3-13H,1-2H3
InChIKey PNKYIUKLSZSRPA-UHFFFAOYSA-N
Molecular Weight 263.340 g/mol
SMILES C1(N(C(=Cc2ccccc12)c1ccccc1)C(C)C)=O
SPLASH splash10-0229-0090000000-56e3ca3d5ec4834b9fce
Source of Spectrum J-58-3117-15
Wiley ID 1267195