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2-Benzyl-3-(4-methoxyphenyl)-3,4,4a,7-tetrahydroisoquinolin-1(2H)-one
SpectraBase Compound ID 3QCybB1jPqS
InChI InChI=1S/C23H23NO2/c1-26-20-13-11-18(12-14-20)22-15-19-9-5-6-10-21(19)23(25)24(22)16-17-7-3-2-4-8-17/h2-5,7-14,19,22H,6,15-16H2,1H3
InChIKey ORPXJMCCCCSVNI-UHFFFAOYSA-N
Mol Weight 345.44 g/mol
Molecular Formula C23H23NO2
Exact Mass 345.172879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DuKNn47y56F
Name 2-Benzyl-3-(4-methoxyphenyl)-3,4,4a,7-tetrahydroisoquinolin-1(2H)-one
Comments Less than 3 mono-isotopic peaks
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Formula C23H23NO2
InChI InChI=1S/C23H23NO2/c1-26-20-13-11-18(12-14-20)22-15-19-9-5-6-10-21(19)23(25)24(22)16-17-7-3-2-4-8-17/h2-5,7-14,19,22H,6,15-16H2,1H3
InChIKey ORPXJMCCCCSVNI-UHFFFAOYSA-N
Molecular Weight 345.442 g/mol
SMILES C1(N(C(CC2C=CCC=C12)c1ccc(cc1)OC)Cc1ccccc1)=O
SPLASH splash10-0006-7009000000-49519ee5f1c581ddfa90
Source of Spectrum J-56-4979-5
Synonyms 2-benzyl-3-(4-methoxyphenyl)-3,4,4a,7-tetrahydro-1(2H)-isoquinolinone
Wiley ID 1338813