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5-Methyl-2-phenyl-3,3a,4,6,11,11a,12,12a-octahydro-1H-isoindolo[6,7-g]quinolizin-1,3,8-trione
SpectraBase Compound ID 1kwi8sMOOqu
InChI InChI=1S/C22H22N2O3/c1-13-10-17-20(22(27)24(21(17)26)14-6-3-2-4-7-14)16-11-15-8-5-9-19(25)23(15)12-18(13)16/h2-7,9,15-17,20H,8,10-12H2,1H3
InChIKey XQNWLRGINPHKEN-UHFFFAOYSA-N
Mol Weight 362.43 g/mol
Molecular Formula C22H22N2O3
Exact Mass 362.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IwUI0WhaelX
Name 5-Methyl-2-phenyl-3,3a,4,6,11,11a,12,12a-octahydro-1H-isoindolo[6,7-g]quinolizin-1,3,8-trione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22N2O3
InChI InChI=1S/C22H22N2O3/c1-13-10-17-20(22(27)24(21(17)26)14-6-3-2-4-7-14)16-11-15-8-5-9-19(25)23(15)12-18(13)16/h2-7,9,15-17,20H,8,10-12H2,1H3
InChIKey XQNWLRGINPHKEN-UHFFFAOYSA-N
Molecular Weight 362.429 g/mol
SMILES C1C=CC(N2CC=3C(CC12)C1C(N(C(C1CC3C)=O)c1ccccc1)=O)=O
SPLASH splash10-03k9-0709000000-d41aa9b1d31b3b4dc659
Source of Spectrum F-69-6309-11
Synonyms 5-methyl-2-phenyl-3a,4,6,11,11a,12,12a,12b-octahydropyrido[1,2-b]pyrrolo[3,4-f]isoquinoline-1,3,8(2H)-trione
Wiley ID 1595667