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2-[[2-(1-adamantylcarbonyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindole-1,3-dione
SpectraBase Compound ID LLY8o0tMo7Z
InChI InChI=1S/C29H30N2O3/c32-26-23-7-3-4-8-24(23)27(33)31(26)17-25-22-6-2-1-5-21(22)9-10-30(25)28(34)29-14-18-11-19(15-29)13-20(12-18)16-29/h1-8,18-20,25H,9-17H2
InChIKey IHFIGTFDWRKXHD-UHFFFAOYSA-N
Mol Weight 454.57 g/mol
Molecular Formula C29H30N2O3
Exact Mass 454.225643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F5AIDNRnLC
Name 2-[[2-(1-adamantylcarbonyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindole-1,3-dione
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Formula C29H30N2O3
InChI InChI=1S/C29H30N2O3/c32-26-23-7-3-4-8-24(23)27(33)31(26)17-25-22-6-2-1-5-21(22)9-10-30(25)28(34)29-14-18-11-19(15-29)13-20(12-18)16-29/h1-8,18-20,25H,9-17H2
InChIKey IHFIGTFDWRKXHD-UHFFFAOYSA-N
Molecular Weight 454.570 g/mol
SMILES c1ccc2C(N(C(C34CC5CC(C4)CC(C3)C5)=O)CCc2c1)CN1C(c2ccccc2C1=O)=O
SPLASH splash10-000f-0590000000-7cb2f0b6391a1cdc3e57
Synonyms 2-[[2-(adamantane-1-carbonyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindole-1,3-dione 2-[[2-(adamantane-1-carbonyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindoline-1,3-dione 2-[[2-(adamantane-1-carbonyl)-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindoline-1,3-quinone 2-[[2-[1-adamantyl(oxo)methyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindole-1,3-dione
Wiley ID 1464548