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4-Chloro-2-isopropyl-3-phenyl-1-isoquinolone
SpectraBase Compound ID 99AA3jCcCww
InChI InChI=1S/C18H16ClNO/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 GUGJBLBCRLHLLP-UHFFFAOYSA-N
Mol Weight 297.79 g/mol
Molecular Formula C18H16ClNO
Exact Mass 297.092042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9h0dsLSHxd8
Name 4-Chloro-2-isopropyl-3-phenyl-1-isoquinolone
Alternate Name(s) 4-Chloro-3-phenyl-2-propan-2-yl-1-isoquinolinone 4-Chloro-3-phenyl-2-propan-2-ylisoquinolin-1-one 4-Chloro-2-isopropyl-3-phenyl-isoquinolin-1-one 4-Chloranyl-3-phenyl-2-propan-2-yl-isoquinolin-1-one
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Formula C18H16ClNO
InChI InChI=1S/C18H16ClNO/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 GUGJBLBCRLHLLP-UHFFFAOYSA-N
Molecular Weight 297.785 g/mol
SMILES C=1(N(C(c2c(C1Cl)cccc2)=O)C(C)C)c1ccccc1
SPLASH splash10-0a4i-0090000000-56e06a7ec2f35068f49c
Source of Spectrum J-58-3117-15i
Wiley ID 1296421