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4-((1'S,2'R,4'S,5'S)-2'-Acetoxymethyl-1'-azabicyclo[2.2.2]oct-5'-yl)-(Z)-4-hexen-5-yn-2-one
SpectraBase Compound ID 9nxMaFfHH1w
InChI InChI=1S/C18H25NO3/c1-4-15(9-13(2)20)5-6-17-11-19-8-7-16(17)10-18(19)12-22-14(3)21/h4,16-18H,7-12H2,1-3H3/b15-4-/t16-,17-,18+/m0/s1
InChIKey VNKWBAHUSWSMHL-KABWPPRASA-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 CmwcMN6Kx3E
Name 4-((1'S,2'R,4'S,5'S)-2'-Acetoxymethyl-1'-azabicyclo[2.2.2]oct-5'-yl)-(Z)-4-hexen-5-yn-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25NO3
InChI InChI=1S/C18H25NO3/c1-4-15(9-13(2)20)5-6-17-11-19-8-7-16(17)10-18(19)12-22-14(3)21/h4,16-18H,7-12H2,1-3H3/b15-4-/t16-,17-,18+/m0/s1
InChIKey VNKWBAHUSWSMHL-KABWPPRASA-N
Molecular Weight 303.402 g/mol
SMILES [C@@]1(N2CC[C@](C1)([H])[C@@](C#C\C(=C\C)CC(=O)C)(C2)[H])(COC(=O)C)[H]
SPLASH splash10-0w30-0096000000-d38da9b3da0594ff14fc
Source of Spectrum F-65-6231-8c
Wiley ID 1680205