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3-[8-(2-methyl-1,3-dioxolan-2-yl)-5-azabicyclo[2.2.2]oct-2-en-5-yl]-4-prop-2-enyl-1-cyclohex-2-enone
SpectraBase Compound ID 1tfi6IUXEE8
InChI InChI=1S/C20H27NO3/c1-3-4-15-6-7-16(22)12-19(15)21-13-14-5-8-18(21)17(11-14)20(2)23-9-10-24-20/h3,5,8,12,14-15,17-18H,1,4,6-7,9-11,13H2,2H3/t14-,15?,17+,18+/m1/s1
InChIKey ZJJSVLIRYQDBGZ-YZYLHUITSA-N
Mol Weight 329.44 g/mol
Molecular Formula C20H27NO3
Exact Mass 329.199094 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BmBEY1Wma8A
Name 3-[8-(2-methyl-1,3-dioxolan-2-yl)-5-azabicyclo[2.2.2]oct-2-en-5-yl]-4-prop-2-enyl-1-cyclohex-2-enone
Alternate Name(s) 3-[8-(2-methyl-1,3-dioxolan-2-yl)-5-azabicyclo[2.2.2]oct-2-en-5-yl]-4-prop-2-enyl-cyclohex-2-en-1-one 4-Allyl-3-[8-(2-methyl-1,3-dioxolan-2-yl)-5-azabicyclo[2.2.2]oct-2-en-5-yl]cyclohex-2-en-1-one
CAS Registry Number 78890-91-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H27NO3
InChI InChI=1S/C20H27NO3/c1-3-4-15-6-7-16(22)12-19(15)21-13-14-5-8-18(21)17(11-14)20(2)23-9-10-24-20/h3,5,8,12,14-15,17-18H,1,4,6-7,9-11,13H2,2H3/t14-,15?,17+,18+/m1/s1
InChIKey ZJJSVLIRYQDBGZ-YZYLHUITSA-N
Molecular Weight 329.440 g/mol
SMILES C1(N2[C@@]3([C@@](C4(OCCO4)C)(C[C@@](C=C3)(C2)[H])[H])[H])=CC(=O)CCC1CC=C
SPLASH splash10-0079-6963000000-5fc658c72d9c224d9b60
Source of Spectrum J-46-4653-0
Wiley ID 1327235