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3-Iodomethyl-2,3-diphenylisoindolin-1-one
SpectraBase Compound ID JgXgV3ObTf0
InChI InChI=1S/C21H16INO/c22-15-21(16-9-3-1-4-10-16)19-14-8-7-13-18(19)20(24)23(21)17-11-5-2-6-12-17/h1-14H,15H2
InChIKey MWPYYWSEWHGGJS-UHFFFAOYSA-N
Mol Weight 425.27 g/mol
Molecular Formula C21H16INO
Exact Mass 425.027659 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3dmkqOfL6Y2
Name 3-Iodomethyl-2,3-diphenylisoindolin-1-one
Alternate Name(s) 3-(iodomethyl)-2,3-diphenyl-1-isoindolinone
Comments Less than 3 mono-isotopic peaks
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Formula C21H16INO
InChI InChI=1S/C21H16INO/c22-15-21(16-9-3-1-4-10-16)19-14-8-7-13-18(19)20(24)23(21)17-11-5-2-6-12-17/h1-14H,15H2
InChIKey MWPYYWSEWHGGJS-UHFFFAOYSA-N
Molecular Weight 425.269 g/mol
SMILES C1(N(C(c2ccccc12)(c1ccccc1)CI)c1ccccc1)=O
SPLASH splash10-001i-0090100000-29ad0482b4f1e1ef4423
Source of Spectrum F4-0-2495-3
Wiley ID 1620239