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Amodiaquine TMS
SpectraBase Compound ID JxMUqhePtGm
InChI InChI=1S/C23H30ClN3OSi/c1-6-27(7-2)16-17-14-19(9-11-23(17)28-29(3,4)5)26-21-12-13-25-22-15-18(24)8-10-20(21)22/h8-15H,6-7,16H2,1-5H3,(H,25,26)
InChIKey LWYHGXQDKMEWAS-UHFFFAOYSA-N
Mol Weight 428.05 g/mol
Molecular Formula C23H30ClN3OSi
Exact Mass 427.184667 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 63mwM5tGYdj
Name Amodiaquine TMS
Classification Antimalarial
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Exact Mass 427.184666832 u
Formula C23H30N3OClSi
InChI InChI=1S/C23H30ClN3OSi/c1-6-27(7-2)16-17-14-19(9-11-23(17)28-29(3,4)5)26-21-12-13-25-22-15-18(24)8-10-20(21)22/h8-15H,6-7,16H2,1-5H3,(H,25,26)
InChIKey LWYHGXQDKMEWAS-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 428.051 g/mol
SMILES C[Si](Oc1c(cc(cc1)Nc1c2ccc(cc2ncc1)Cl)CN(CC)CC)(C)C
SPLASH splash10-0a4i-6349100000-a40e08f2f272dbc8893e
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_7836