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6H-Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizine-12-carboxylic acid, 5,8,9,10,11,12,13,13a-octahydro-11-oxo-, methyl ester
SpectraBase Compound ID 4dwraePDBHr
InChI InChI=1S/C20H21NO5/c1-24-20(23)19-14-7-15-13-8-18-17(25-10-26-18)6-11(13)4-5-21(15)9-12(14)2-3-16(19)22/h6,8,15,19H,2-5,7,9-10H2,1H3
InChIKey OSAIFHGTRKBDCI-UHFFFAOYSA-N
Mol Weight 355.39 g/mol
Molecular Formula C20H21NO5
Exact Mass 355.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HoPHtZ9zJxn
Name 6H-Benzo[g]-1,3-benzodioxolo[5,6-a]quinolizine-12-carboxylic acid, 5,8,9,10,11,12,13,13a-octahydro-11-oxo-, methyl ester
CAS Registry Number 59904-94-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21NO5
InChI InChI=1S/C20H21NO5/c1-24-20(23)19-14-7-15-13-8-18-17(25-10-26-18)6-11(13)4-5-21(15)9-12(14)2-3-16(19)22/h6,8,15,19H,2-5,7,9-10H2,1H3
InChIKey OSAIFHGTRKBDCI-UHFFFAOYSA-N
Molecular Weight 355.390 g/mol
SMILES C1=2C(C(=O)OC)C(=O)CCC2CN2C(C1)c1c(cc3c(c1)OCO3)CC2
SPLASH splash10-004i-0905000000-edb37e7920cafb109965
Source of Spectrum K-109-1733-0
Synonyms Methyl 11-oxo-5,8,9,10,11,12,13,13a-octahydro-6H-[1,3]dioxolo[4,5-g]isoquino[3,2-a]isoquinoline-12-carboxylate Methyl 7,8-methylencioxy-14-oxo-12,17-didehydroberban-13-carboxylate
Wiley ID 1345257