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Dimethyl cis-6.beta.-hydroxy-6,7,10,11,12,12a-hexahydro-9H-pyrido[1',2':1,2]pyrazino[4,3-b]indole-11-malonate
SpectraBase Compound ID DG2bWIgayNK
InChI InChI=1S/C20H24N2O5/c1-26-19(24)18(20(25)27-2)13-7-8-21-11-17(23)22-14-6-4-3-5-12(14)9-16(22)15(21)10-13/h3-6,9,13,15,17-18,23H,7-8,10-11H2,1-2H3/t13-,15+,17-/m1/s1
InChIKey WWRIPGNNAGMVCM-UKPHBRMFSA-N
Mol Weight 372.42 g/mol
Molecular Formula C20H24N2O5
Exact Mass 372.168522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FuJN3E37zIe
Name Dimethyl cis-6.beta.-hydroxy-6,7,10,11,12,12a-hexahydro-9H-pyrido[1',2':1,2]pyrazino[4,3-b]indole-11-malonate
Alternate Name(s) 2-((2R,6R,11bS)-6-Hydroxy-1,3,4,5,6,11b-hexahydro-2H-4a,6a-diaza-benzo[a]fluoren-2-yl)-malonic acid dimethyl ester Dimethyl 2-[(6S,12aR)-6-hydroxy-4,6,7,9,10,11,12,12a-octahydroindolo[3,2-a]quinolizin-11-yl]malonate
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Formula C20H24N2O5
InChI InChI=1S/C20H24N2O5/c1-26-19(24)18(20(25)27-2)13-7-8-21-11-17(23)22-14-6-4-3-5-12(14)9-16(22)15(21)10-13/h3-6,9,13,15,17-18,23H,7-8,10-11H2,1-2H3/t13-,15+,17-/m1/s1
InChIKey WWRIPGNNAGMVCM-UKPHBRMFSA-N
Molecular Weight 372.421 g/mol
SMILES O[C@]1([n]2c([C@]3(N(C1)CC[C@@](C(C(=O)OC)C(=O)OC)(C3)[H])[H])cc1ccccc21)[H]
SPLASH splash10-00di-4359000000-f73bf67b149bbab8e8bd
Source of Spectrum J-62-3173-31
Wiley ID 1355428