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IWBANHMNZOIFLA-HSMVNMDESA-N

View entire compound with spectra: 1 NMR, and 1 MS (GC)

IWBANHMNZOIFLA-HSMVNMDESA-N
SpectraBase Compound ID EG7OwMwF8jN
InChI InChI=1S/C17H22N2O/c1-11(20)12-6-7-16-17-14(8-9-19(16)10-12)13-4-2-3-5-15(13)18-17/h2-5,11-12,16,18,20H,6-10H2,1H3/t11-,12-,16+/m1/s1
InChIKey IWBANHMNZOIFLA-HSMVNMDESA-N
Mol Weight 270.38 g/mol
Molecular Formula C17H22N2O
Exact Mass 270.173213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 50YKQdOJ9M
Name 12b-epi-3-(1.alpha.-Hydroxyethyl)-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizine
Alternate Name(s) (1R)-1-[(3R,12bS)-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-3-yl]ethanol
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Formula C17H22N2O
InChI InChI=1S/C17H22N2O/c1-11(20)12-6-7-16-17-14(8-9-19(16)10-12)13-4-2-3-5-15(13)18-17/h2-5,11-12,16,18,20H,6-10H2,1H3/t11-,12-,16+/m1/s1
InChIKey IWBANHMNZOIFLA-HSMVNMDESA-N
Molecular Weight 270.376 g/mol
SMILES [nH]1c2ccccc2c2CCN3[C@@](CC[C@@]([C@](O)(C)[H])(C3)[H])(c12)[H]
SPLASH splash10-00xr-0290000000-e855998a8e7d07b8af1b
Source of Spectrum H1-45-1402-8
Wiley ID 815811