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(+)-(1S,6S,7S,1'R)-7-(1'-Acetoxyethyl)-6-(benzyloxy)-2-azabicyclo[2.2.2]octane

View entire compound with spectra: 1 MS (GC)

(+)-(1S,6S,7S,1'R)-7-(1'-Acetoxyethyl)-6-(benzyloxy)-2-azabicyclo[2.2.2]octane
SpectraBase Compound ID FqymIC26buV
InChI InChI=1S/C18H25NO3/c1-12(22-13(2)20)16-8-15-9-17(18(16)19-10-15)21-11-14-6-4-3-5-7-14/h3-7,12,15-19H,8-11H2,1-2H3/t12-,15?,16-,17+,18+/m1/s1
InChIKey ZLPWSZWYQCICMK-BVXMROAISA-N
Mol Weight 303.4 g/mol
Molecular Formula C18H25NO3
Exact Mass 303.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ElYZOUykRZ4
Name (+)-(1S,6S,7S,1'R)-7-(1'-Acetoxyethyl)-6-(benzyloxy)-2-azabicyclo[2.2.2]octane
Alternate Name(s) (1R)-1-[(1S,6S,7S)-7-(benzyloxy)-2-azabicyclo[2.2.2]oct-6-yl]ethyl acetate
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Formula C18H25NO3
InChI InChI=1S/C18H25NO3/c1-12(22-13(2)20)16-8-15-9-17(18(16)19-10-15)21-11-14-6-4-3-5-7-14/h3-7,12,15-19H,8-11H2,1-2H3/t12-,15?,16-,17+,18+/m1/s1
InChIKey ZLPWSZWYQCICMK-BVXMROAISA-N
Molecular Weight 303.402 g/mol
SMILES N1CC2C[C@@]([C@]1([C@](C2)(OCc1ccccc1)[H])[H])([C@](OC(=O)C)(C)[H])[H]
SPLASH splash10-0f6x-4910000000-842c95f86054db589593
Source of Spectrum KD-15-1808-1
Wiley ID 1637044