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2-Benzyl-3-(4-methoxyphenyl)-6-(trifluoromethyl)-7,8-dihydroisoquinolin-1(2H)-one

View entire compound with spectra: 1 MS (GC)

2-Benzyl-3-(4-methoxyphenyl)-6-(trifluoromethyl)-7,8-dihydroisoquinolin-1(2H)-one
SpectraBase Compound ID GdrjMO6pOpE
InChI InChI=1S/C24H20F3NO2/c1-30-20-10-7-17(8-11-20)22-14-18-13-19(24(25,26)27)9-12-21(18)23(29)28(22)15-16-5-3-2-4-6-16/h2-8,10-11,13-14H,9,12,15H2,1H3
InChIKey PJESWZOOOKSHBF-UHFFFAOYSA-N
Mol Weight 411.42 g/mol
Molecular Formula C24H20F3NO2
Exact Mass 411.144613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Vp6E3eLSPh
Name 2-Benzyl-3-(4-methoxyphenyl)-6-(trifluoromethyl)-7,8-dihydroisoquinolin-1(2H)-one
Comments Less than 3 mono-isotopic peaks
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Formula C24H20F3NO2
InChI InChI=1S/C24H20F3NO2/c1-30-20-10-7-17(8-11-20)22-14-18-13-19(24(25,26)27)9-12-21(18)23(29)28(22)15-16-5-3-2-4-6-16/h2-8,10-11,13-14H,9,12,15H2,1H3
InChIKey PJESWZOOOKSHBF-UHFFFAOYSA-N
Molecular Weight 411.424 g/mol
SMILES C1(N(C(=CC=2C=C(CCC12)C(F)(F)F)c1ccc(cc1)OC)Cc1ccccc1)=O
SPLASH splash10-0006-9000400000-7b40a591e78883ef7779
Source of Spectrum J-56-4979-2
Synonyms 2-benzyl-3-(4-methoxyphenyl)-6-(trifluoromethyl)-7,8-dihydro-1(2H)-isoquinolinone
Wiley ID 1374139