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2-[2-(N,N-Diethylamino)ethyl]-3-(p-tolyl)-1-oxo-2,3,4,5,6,7-hexahydro-1H-isoindole
SpectraBase Compound ID GDAej3IPeUV
InChI InChI=1S/C21H30N2O/c1-4-22(5-2)14-15-23-20(17-12-10-16(3)11-13-17)18-8-6-7-9-19(18)21(23)24/h10-13,20H,4-9,14-15H2,1-3H3
InChIKey JHAQUFNXNSEZTO-UHFFFAOYSA-N
Mol Weight 326.48 g/mol
Molecular Formula C21H30N2O
Exact Mass 326.235814 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 12rEuqQC5zf
Name 2-[2-(N,N-Diethylamino)ethyl]-3-(p-tolyl)-1-oxo-2,3,4,5,6,7-hexahydro-1H-isoindole
Alternate Name(s) 2-(2-diethylaminoethyl)-3-(4-methylphenyl)-4,5,6,7-tetrahydro-3H-isoindol-1-one 2-(2-diethylaminoethyl)-3-(p-tolyl)-4,5,6,7-tetrahydro-3H-isoindol-1-one 2-[2-(diethylamino)ethyl]-3-(4-methylphenyl)-2,3,4,5,6,7-hexahydro-1H-isoindol-1-one 2-[2-(diethylamino)ethyl]-3-(4-methylphenyl)-4,5,6,7-tetrahydro-3H-isoindol-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C21H30N2O
InChI InChI=1S/C21H30N2O/c1-4-22(5-2)14-15-23-20(17-12-10-16(3)11-13-17)18-8-6-7-9-19(18)21(23)24/h10-13,20H,4-9,14-15H2,1-3H3
InChIKey JHAQUFNXNSEZTO-UHFFFAOYSA-N
Molecular Weight 326.484 g/mol
SMILES C1(N(C(C=2CCCCC12)c1ccc(cc1)C)CCN(CC)CC)=O
SPLASH splash10-0fb9-0089000000-a64143f677d1392a797c
Source of Spectrum H1-36-1820-2
Wiley ID 755259