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2H-Benzo[b]quinolizine-10,11-diol, dodecahydro-11-methyl-, 10-acetate, (6a.alpha.,10.alpha.,10a.beta.,11.alpha.,11a.alpha.)-(.+-.)-
SpectraBase Compound ID LwcwsJCrJrX
InChI InChI=1S/C16H27NO3/c1-11(18)20-13-7-5-6-12-10-17-9-4-3-8-14(17)16(2,19)15(12)13/h12-15,19H,3-10H2,1-2H3/t12-,13-,14-,15-,16+/m1/s1
InChIKey XJZBYGFFJGKBOM-QCODTGAPSA-N
Mol Weight 281.4 g/mol
Molecular Formula C16H27NO3
Exact Mass 281.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CwS2FgUVGis
Name 2H-Benzo[b]quinolizine-10,11-diol, dodecahydro-11-methyl-, 10-acetate, (6a.alpha.,10.alpha.,10a.beta.,11.alpha.,11a.alpha.)-(.+-.)-
CAS Registry Number 82741-91-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H27NO3
InChI InChI=1S/C16H27NO3/c1-11(18)20-13-7-5-6-12-10-17-9-4-3-8-14(17)16(2,19)15(12)13/h12-15,19H,3-10H2,1-2H3/t12-,13-,14-,15-,16+/m1/s1
InChIKey XJZBYGFFJGKBOM-QCODTGAPSA-N
Molecular Weight 281.396 g/mol
SMILES O[C@@]1([C@@]2([C@@](CCC[C@]2(OC(=O)C)[H])([H])CN2[C@@]1(CCCC2)[H])[H])C
SPLASH splash10-0002-9060000000-f06643a09960efc7a7ca
Source of Spectrum J-47-4144-0
Synonyms (6aS,10R,10aR,11R,11aR)-11-hydroxy-11-methyldodecahydro-2H-pyrido[1,2-b]isoquinolin-10-yl acetate 10.beta.-acetoxy-11.beta.-hydroxy-11.alpha.-methyl-1,3,4,6,6a.beta.,7,8,9,10.alpha.,10a.alpha.,11,11a.beta.-dodecahydro-2H-benzo[b]quinolizine
Wiley ID 1284946