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AcCD

View entire compound with spectra: 1 MS (GC)

AcCD
SpectraBase Compound ID FyiXAs4HkaA
InChI InChI=1S/C21H24N2O2/c1-3-15-13-23-11-9-16(15)12-20(23)21(25-14(2)24)18-8-10-22-19-7-5-4-6-17(18)19/h3-8,10,15-16,20-21H,1,9,11-13H2,2H3/t15-,16-,20-,21+/m0/s1
InChIKey NDBICTMGDYGBFE-SNHGZMDHSA-N
Mol Weight 336.44 g/mol
Molecular Formula C21H24N2O2
Exact Mass 336.183778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EHN7jgfEsHz
Name AcCD
Alternate Name(s) (8alpha,9R)-cinchonan-9-yl acetate Acetylcinchonidine Acetic acid [(R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-(4-quinolinyl)methyl] ester [(R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethyl] acetate [(R)-4-quinolyl-[(2S,4S,5R)-5-vinylquinuclidin-2-yl]methyl] acetate [(R)-[(2S,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-quinolin-4-yl-methyl] ethanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24N2O2
InChI InChI=1S/C21H24N2O2/c1-3-15-13-23-11-9-16(15)12-20(23)21(25-14(2)24)18-8-10-22-19-7-5-4-6-17(18)19/h3-8,10,15-16,20-21H,1,9,11-13H2,2H3/t15-,16-,20-,21+/m0/s1
InChIKey NDBICTMGDYGBFE-SNHGZMDHSA-N
Molecular Weight 336.435 g/mol
SMILES [C@]1(N2CC[C@](C1)([H])[C@](C2)(C=C)[H])([C@@](c1c2c(cccc2)ncc1)(OC(=O)C)[H])[H]
SPLASH splash10-000i-0900000000-a8343022ee365d2e4fc3
Source of Spectrum O-35-713-17
Wiley ID 818205