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(4R,4aR,13aS)-4-Ethyl-3,4,4a,5,7,13a-hexahydro-2-methyl-1H-pyrido[3',4' ; 5,6]cyclooct[1,2-b]indole-1,6(2H)-dione
SpectraBase Compound ID GrA6RV1CzXB
InChI InChI=1S/C20H22N2O2/c1-3-12-11-22(2)20(24)15-9-8-14-13-6-4-5-7-17(13)21-19(14)18(23)10-16(12)15/h4-9,12,15-16,21H,3,10-11H2,1-2H3/b9-8-/t12-,15-,16+/m0/s1
InChIKey YNPSSZOAHYCMMM-YDSGTJQWSA-N
Mol Weight 322.41 g/mol
Molecular Formula C20H22N2O2
Exact Mass 322.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8i6sPcTiIdv
Name (4R,4aR,13aS)-4-Ethyl-3,4,4a,5,7,13a-hexahydro-2-methyl-1H-pyrido[3',4' ; 5,6]cyclooct[1,2-b]indole-1,6(2H)-dione
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Formula C20H22N2O2
InChI InChI=1S/C20H22N2O2/c1-3-12-11-22(2)20(24)15-9-8-14-13-6-4-5-7-17(13)21-19(14)18(23)10-16(12)15/h4-9,12,15-16,21H,3,10-11H2,1-2H3/b9-8-/t12-,15-,16+/m0/s1
InChIKey YNPSSZOAHYCMMM-YDSGTJQWSA-N
Molecular Weight 322.408 g/mol
SMILES [nH]1c2ccccc2c2c1C(C[C@@]1([C@](CN(C([C@]1(\C=C/2)[H])=O)C)(CC)[H])[H])=O
SPLASH splash10-0abi-9002000000-9b965e75f3e16e78d3f3
Source of Spectrum H-90-1470-2
Synonyms Flabelliformide A (4R,4aR,13aR)-4-Ethyl-3,4,4a,5,7,13a-hexahydro-2-methyl-1H-pyrido[3',4' ; 5,6]cyclooct[1,2-b]indole-1,6(2H)-dione (4R,4aR,13aS)-4-ethyl-2-methyl-3,4,4a,5,7,13a-hexahydro-1H-pyrido[3',4':5,6]cycloocta[1,2-b]indole-1,6(2H)-dione Flabelliformide B
Wiley ID 1590769