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4-Bromanyl-3-phenyl-2-propan-2-yl-isoquinolin-1-one
SpectraBase Compound ID 5Th21fRYGur
InChI InChI=1S/C18H16BrNO/c1-12(2)20-17(13-8-4-3-5-9-13)16(19)14-10-6-7-11-15(14)18(20)21/h3-12H,1-2H3
InChIKey KBQQNGBGWOZIKO-UHFFFAOYSA-N
Mol Weight 342.24 g/mol
Molecular Formula C18H16BrNO
Exact Mass 341.041527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EQ79PprplKJ
Name 4-Bromanyl-3-phenyl-2-propan-2-yl-isoquinolin-1-one
Alternate Name(s) 4-Bromo-2-isopropyl-3-phenyl-isocarbostyril 4-Bromo-2-isopropyl-3-phenyl-isoquinolin-1-one 4-Bromo-3-phenyl-2-propan-2-yl-1-isoquinolinone 4-Bromo-3-phenyl-2-propan-2-ylisoquinolin-1-one
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Formula C18H16BrNO
InChI InChI=1S/C18H16BrNO/c1-12(2)20-17(13-8-4-3-5-9-13)16(19)14-10-6-7-11-15(14)18(20)21/h3-12H,1-2H3
InChIKey KBQQNGBGWOZIKO-UHFFFAOYSA-N
Molecular Weight 342.236 g/mol
SMILES C=1(N(C(c2c(C1Br)cccc2)=O)C(C)C)c1ccccc1
SPLASH splash10-0f6w-0059000000-8b1ad72d995d72c5c41a
Source of Spectrum J-58-3117-15
Wiley ID 1335856