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tert-Butyl ester of 2.beta.-acetoxymethyl-4.beta.-methyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-3.alpha.-carboxylic acid
SpectraBase Compound ID FM8NmzmiuE2
InChI InChI=1S/C24H32N2O4/c1-14-21(23(28)30-24(3,4)5)16(13-29-15(2)27)12-20-22-18(10-11-26(14)20)17-8-6-7-9-19(17)25-22/h6-9,14,16,20-21,25H,10-13H2,1-5H3/t14-,16+,20?,21-/m1/s1
InChIKey WMLSKHKDLNKWII-LRNAMARESA-N
Mol Weight 412.5 g/mol
Molecular Formula C24H32N2O4
Exact Mass 412.236208 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hT7dzKSCO
Name tert-Butyl ester of 2.beta.-acetoxymethyl-4.beta.-methyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-3.alpha.-carboxylic acid
Alternate Name(s) tert-Butyl (2R,3S,4R)-2-[(acetyloxy)methyl]-4-methyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizine-3-carboxylate
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Formula C24H32N2O4
InChI InChI=1S/C24H32N2O4/c1-14-21(23(28)30-24(3,4)5)16(13-29-15(2)27)12-20-22-18(10-11-26(14)20)17-8-6-7-9-19(17)25-22/h6-9,14,16,20-21,25H,10-13H2,1-5H3/t14-,16+,20?,21-/m1/s1
InChIKey WMLSKHKDLNKWII-LRNAMARESA-N
Molecular Weight 412.530 g/mol
SMILES [nH]1c2ccccc2c2CCN3C(c12)C[C@]([C@@]([C@]3(C)[H])(C(OC(C)(C)C)=O)[H])(COC(=O)C)[H]
SPLASH splash10-0j4i-0298600000-219d524d1882644a0d9f
Source of Spectrum K-111-1546-0
Wiley ID 1374510