For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
6-((1'S,2'R,4'S,5'S)-2'-Acetoxymethyl-1'-azabicyclo[2.2.2]oct-5'-yl)-4-ethyl-(E)-3-hexen-5-yn-2-one
SpectraBase Compound ID KrEiQSNzdxs
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/h9,16-18H,4,7-8,10-12H2,1-3H3/b15-9+/t16-,17-,18+/m0/s1
InChIKey LWEDIRJWHNGVKK-IRAOJIRXSA-N
Mol Weight 303.4 g/mol
Molecular Formula C18H25NO3
Exact Mass 303.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DghccmGULgD
Name 6-((1'S,2'R,4'S,5'S)-2'-Acetoxymethyl-1'-azabicyclo[2.2.2]oct-5'-yl)-4-ethyl-(E)-3-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/h9,16-18H,4,7-8,10-12H2,1-3H3/b15-9+/t16-,17-,18+/m0/s1
InChIKey LWEDIRJWHNGVKK-IRAOJIRXSA-N
Molecular Weight 303.402 g/mol
SMILES [C@@]1(N2CC[C@](C1)([H])[C@@](C#C\C(=C\C(=O)C)CC)(C2)[H])(COC(=O)C)[H]
SPLASH splash10-0ue9-0095000000-c453db8ad82a439cf87c
Source of Spectrum F-65-6231-8b
Wiley ID 1680206