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1-[2-(benzo[1,3]dioxole-5-carbonyloxy)-ethyl]-5-methyl-octahydro-quinolizinium iodide
SpectraBase Compound ID BLPSmKjIEF8
InChI InChI=1S/C20H28NO4.HI/c1-21-10-3-2-6-17(21)15(5-4-11-21)9-12-23-20(22)16-7-8-18-19(13-16)25-14-24-18;/h7-8,13,15,17H,2-6,9-12,14H2,1H3;1H/q+1;/p-1
InChIKey JNSWCFQXZUTVIL-UHFFFAOYSA-M
Mol Weight 473.35 g/mol
Molecular Formula C20H28INO4
Exact Mass 473.106303 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6uIgIFDjc6X
Name 1-[2-(benzo[1,3]dioxole-5-carbonyloxy)-ethyl]-5-methyl-octahydro-quinolizinium iodide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28INO4
InChI InChI=1S/C20H28NO4.HI/c1-21-10-3-2-6-17(21)15(5-4-11-21)9-12-23-20(22)16-7-8-18-19(13-16)25-14-24-18;/h7-8,13,15,17H,2-6,9-12,14H2,1H3;1H/q+1;/p-1
InChIKey JNSWCFQXZUTVIL-UHFFFAOYSA-M
Molecular Weight 473.351 g/mol
SMILES [I-].c1c2c(cc(c1)C(=O)OCCC1CCC[N+]3(C1CCCC3)C)OCO2
SPLASH splash10-00l5-7900000000-c3340e843258a596ec17
Synonyms 1-{2-[(1,3-benzodioxol-5-ylcarbonyl)oxy]ethyl}-5-methyloctahydro-2H-quinolizinium iodide
Wiley ID 1446403