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1,14-Secoeburnamenine-14-carboxylic acid, 14,15-dihydro-, ethyl ester, (3.alpha.,16.alpha.)-

View entire compound with spectra: 1 MS (GC)

1,14-Secoeburnamenine-14-carboxylic acid, 14,15-dihydro-, ethyl ester, (3.alpha.,16.alpha.)-
SpectraBase Compound ID LVDOx4b8bMh
InChI InChI=1S/C22H30N2O2/c1-3-22(13-10-19(25)26-4-2)12-7-14-24-15-11-17-16-8-5-6-9-18(16)23-20(17)21(22)24/h5-6,8-9,21,23H,3-4,7,10-15H2,1-2H3/t21-,22+/m1/s1
InChIKey GTRGLQXBIACGAP-YADHBBJMSA-N
Mol Weight 354.49 g/mol
Molecular Formula C22H30N2O2
Exact Mass 354.230728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID QXO7goFs
Name 1,14-Secoeburnamenine-14-carboxylic acid, 14,15-dihydro-, ethyl ester, (3.alpha.,16.alpha.)-
CAS Registry Number 51049-30-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30N2O2
InChI InChI=1S/C22H30N2O2/c1-3-22(13-10-19(25)26-4-2)12-7-14-24-15-11-17-16-8-5-6-9-18(16)23-20(17)21(22)24/h5-6,8-9,21,23H,3-4,7,10-15H2,1-2H3/t21-,22+/m1/s1
InChIKey GTRGLQXBIACGAP-YADHBBJMSA-N
Molecular Weight 354.494 g/mol
SMILES [nH]1c2ccccc2c2c1[C@]1(N(CC2)CCC[C@]1(CCC(=O)OCC)CC)[H]
SPLASH splash10-014u-0159000000-ff6bb9acfcd5d1d7bc7b
Source of Spectrum H-60-1809-0
Synonyms (1S,12bS)-1-Ethyl-1,2,3,4,5,6,7,12b-octahydro-indolo(2,3-a)-quinolizine-1-propionic acid ethyl ester Ethyl 3-[(1S,12bS)-1-ethyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-1-yl]propanoate Indolo[2,3-a]quinolizine, 1,14-secoeburnamenine-14-carboxylic acid deriv.
Wiley ID 1344898