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Amodiaquine 2TMS
SpectraBase Compound ID GlczhsWNTBR
InChI InChI=1S/C26H38ClN3OSi2/c1-9-29(10-2)19-20-17-22(12-14-26(20)31-33(6,7)8)30(32(3,4)5)25-15-16-28-24-18-21(27)11-13-23(24)25/h11-18H,9-10,19H2,1-8H3
InChIKey CUTKUZMEURZVHP-UHFFFAOYSA-N
Mol Weight 500.2 g/mol
Molecular Formula C26H38ClN3OSi2
Exact Mass 499.224194 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LogasZ7KHEn
Name Amodiaquine 2TMS
Classification Antimalarial
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Exact Mass 499.224193625 u
Formula C26H38N3OClSi2
InChI InChI=1S/C26H38ClN3OSi2/c1-9-29(10-2)19-20-17-22(12-14-26(20)31-33(6,7)8)30(32(3,4)5)25-15-16-28-24-18-21(27)11-13-23(24)25/h11-18H,9-10,19H2,1-8H3
InChIKey CUTKUZMEURZVHP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 500.233 g/mol
SMILES C[Si](N(c1c2ccc(cc2ncc1)Cl)c1ccc(c(CN(CC)CC)c1)O[Si](C)(C)C)(C)C
SPLASH splash10-00fr-9012800000-b0844132c11751b4f095
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_7787