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6'-Methoxycinchonan-9-yl acetate

View entire compound with spectra: 3 MS (GC)

6'-Methoxycinchonan-9-yl acetate
SpectraBase Compound ID CgJnmnv66Y1
InChI InChI=1S/C22H26N2O3/c1-4-15-13-24-10-8-16(15)11-21(24)22(27-14(2)25)18-7-9-23-20-6-5-17(26-3)12-19(18)20/h4-7,9,12,15-16,21-22H,1,8,10-11,13H2,2-3H3/t15-,16+,21?,22?/m0/s1
InChIKey LBXIBQQYUBUMMK-WRUITMHCSA-N
Mol Weight 366.46 g/mol
Molecular Formula C22H26N2O3
Exact Mass 366.194343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IewNnL7M0rV
Name 6'-Methoxycinchonan-9-yl acetate
Alternate Name(s) Acetylquinine Quinidine acetate Quinine acetate Acetic acid [(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxy-4-quinolinyl)methyl] ester [(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methyl] acetate [(6-methoxy-4-quinolyl)-(5-vinylquinuclidin-2-yl)methyl] acetate [(5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methyl] ethanoate
CAS Registry Number 56652-53-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26N2O3
InChI InChI=1S/C22H26N2O3/c1-4-15-13-24-10-8-16(15)11-21(24)22(27-14(2)25)18-7-9-23-20-6-5-17(26-3)12-19(18)20/h4-7,9,12,15-16,21-22H,1,8,10-11,13H2,2-3H3/t15-,16+,21?,22?/m0/s1
InChIKey LBXIBQQYUBUMMK-WRUITMHCSA-N
Molecular Weight 366.461 g/mol
SMILES C1(N2CC[C@](C1)([C@](C2)(C=C)[H])[H])C(c1c2c(ccc(c2)OC)ncc1)OC(=O)C
SPLASH splash10-000i-1900000000-ff1fadaf796ec96aa590
Source of Spectrum NP-13-3844-0
Wiley ID 1111013