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1H-Dibenzo[a,h]quinolizine-2-carboxylic acid, 2,3,4,4a,5,6,8,9,13b,13c-decahydro-11,12-dimethoxy-3-oxo-, methyl ester, (4a.alpha.,13b.alpha.,13c.alpha.)-
SpectraBase Compound ID 48ZUcispDWA
InChI InChI=1S/C21H27NO5/c1-25-18-9-13-5-7-22-6-4-12-8-17(23)16(21(24)27-3)10-14(12)20(22)15(13)11-19(18)26-2/h9,11-12,14,16,20H,4-8,10H2,1-3H3/t12-,14+,16?,20-/m1/s1
InChIKey AMKGRXFKZJCIOV-JMDHZYTPSA-N
Mol Weight 373.45 g/mol
Molecular Formula C21H27NO5
Exact Mass 373.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4oKZjLqsgi
Name 1H-Dibenzo[a,h]quinolizine-2-carboxylic acid, 2,3,4,4a,5,6,8,9,13b,13c-decahydro-11,12-dimethoxy-3-oxo-, methyl ester, (4a.alpha.,13b.alpha.,13c.alpha.)-
CAS Registry Number 74170-73-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27NO5
InChI InChI=1S/C21H27NO5/c1-25-18-9-13-5-7-22-6-4-12-8-17(23)16(21(24)27-3)10-14(12)20(22)15(13)11-19(18)26-2/h9,11-12,14,16,20H,4-8,10H2,1-3H3/t12-,14+,16?,20-/m1/s1
InChIKey AMKGRXFKZJCIOV-JMDHZYTPSA-N
Molecular Weight 373.449 g/mol
SMILES c12[C@]3([C@]4(CC(C(=O)OC)C(C[C@@]4([H])CCN3CCc1cc(c(c2)OC)OC)=O)[H])[H]
SPLASH splash10-00xu-0359000000-ee97c3b9f5ce15755359
Source of Spectrum F-35-2046-0
Synonyms Methyl (4aR,13bR,13cS)-11,12-dimethoxy-3-oxo-2,3,4,4a,5,6,8,9,13b,13c-decahydro-1H-isoquino[1,2-a]isoquinoline-2-carboxylate Methyl-11,12-dimethoxy-3-oxo-(cis,syn-1,2,3,4,4a,5,6,8,9,13c-decahydro-13b.alpha.H-dibenzo[a,h]quinolizin-(2))-yl carboxylate
Wiley ID 1356125