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Propanedioic acid, (1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl)-, dimethyl ester, trans-(.+-.)-
SpectraBase Compound ID nuPC9muyy8
InChI InChI=1S/C20H24N2O4/c1-25-19(23)17(20(24)26-2)12-7-9-22-10-8-14-13-5-3-4-6-15(13)21-18(14)16(22)11-12/h3-6,12,16-17,21H,7-11H2,1-2H3/t12-,16+/m0/s1
InChIKey MMVIBWAWFNERTA-BLLLJJGKSA-N
Mol Weight 356.42 g/mol
Molecular Formula C20H24N2O4
Exact Mass 356.173607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ewv5ccySb7v
Name Propanedioic acid, (1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl)-, dimethyl ester, trans-(.+-.)-
Alternate Name(s) Dimethyl 2-[(2S,12bR)-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]malonate Dimethyl ester of (1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl)-propandioic acid Indolo[2,3-a]quinolizine, propanedioic acid deriv.
CAS Registry Number 82980-24-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24N2O4
InChI InChI=1S/C20H24N2O4/c1-25-19(23)17(20(24)26-2)12-7-9-22-10-8-14-13-5-3-4-6-15(13)21-18(14)16(22)11-12/h3-6,12,16-17,21H,7-11H2,1-2H3/t12-,16+/m0/s1
InChIKey MMVIBWAWFNERTA-BLLLJJGKSA-N
Molecular Weight 356.422 g/mol
SMILES [nH]1c2ccccc2c2c1[C@@]1(N(CC2)CC[C@@](C1)(C(C(=O)OC)C(=O)OC)[H])[H]
SPLASH splash10-0a6r-0249000000-dc8516e1b77c5c94018e
Source of Spectrum J-47-4452-0
Wiley ID 1345843