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(1R,3R,12bR)-3-(2-Methyl-[1,3]dithiolan-2-yl)-1,2,3,4,6,7,12,12b-octahydro-indolo[2,3-a]quinolizine-1-carboxylic acid methyl ester

View entire compound with spectra: 1 MS (GC)

(1R,3R,12bR)-3-(2-Methyl-[1,3]dithiolan-2-yl)-1,2,3,4,6,7,12,12b-octahydro-indolo[2,3-a]quinolizine-1-carboxylic acid methyl ester
SpectraBase Compound ID GRbkVtj79Ll
InChI InChI=1S/C21H26N2O2S2/c1-21(26-9-10-27-21)13-11-16(20(24)25-2)19-18-15(7-8-23(19)12-13)14-5-3-4-6-17(14)22-18/h3-6,13,16,19,22H,7-12H2,1-2H3/t13-,16-,19-/m1/s1
InChIKey SNNBSNGYOWGIJN-VVFCZOMOSA-N
Mol Weight 402.57 g/mol
Molecular Formula C21H26N2O2S2
Exact Mass 402.14357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID bKgnS6if0P
Name (1R,3R,12bR)-3-(2-Methyl-[1,3]dithiolan-2-yl)-1,2,3,4,6,7,12,12b-octahydro-indolo[2,3-a]quinolizine-1-carboxylic acid methyl ester
Alternate Name(s) (1R,3R,12bR)-1-(Methoxycarbonyl)-3-(2-methyl-[1,3]-dithiaolan-2-yl)-1,2,3,4,6,7,12,12b-octahydro-indolo[2,3-a]quinolizine 1-(Methoxycarbonyl)-3-(2-methyl-1,3-dithiaolan-2-yl)indolo[2,3-a]quinolizine Methyl (1R,3R,12bR)-3-(2-methyl-1,3-dithiolan-2-yl)-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizine-1-carboxylate
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Formula C21H26N2O2S2
InChI InChI=1S/C21H26N2O2S2/c1-21(26-9-10-27-21)13-11-16(20(24)25-2)19-18-15(7-8-23(19)12-13)14-5-3-4-6-17(14)22-18/h3-6,13,16,19,22H,7-12H2,1-2H3/t13-,16-,19-/m1/s1
InChIKey SNNBSNGYOWGIJN-VVFCZOMOSA-N
Molecular Weight 402.571 g/mol
SMILES [nH]1c2ccccc2c2CCN3C[C@@](C[C@]([C@@]3(c12)[H])(C(=O)OC)[H])(C1(SCCS1)C)[H]
SPLASH splash10-001i-0930400000-da115093542b5fdea306
Source of Spectrum F-52-11376-40
Wiley ID 798442