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Chloroquine-M (-C2H5) AC
SpectraBase Compound ID BAWL6uz4qOU
InChI InChI=1S/C18H24ClN3O/c1-4-22(14(3)23)11-5-6-13(2)21-17-9-10-20-18-12-15(19)7-8-16(17)18/h7-10,12-13H,4-6,11H2,1-3H3,(H,20,21)
InChIKey HGDLFXICTKRYJP-UHFFFAOYSA-N
Mol Weight 333.86 g/mol
Molecular Formula C18H24ClN3O
Exact Mass 333.16079 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11Hs5b1Kbqp
Name Chloroquine-M (deethyl-) AC
Classification Antimalarial
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Exact Mass 333.160790104 u
Formula C18H24ClN3O
InChI InChI=1S/C18H24ClN3O/c1-4-22(14(3)23)11-5-6-13(2)21-17-9-10-20-18-12-15(19)7-8-16(17)18/h7-10,12-13H,4-6,11H2,1-3H3,(H,20,21)
InChIKey HGDLFXICTKRYJP-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 333.863 g/mol
SMILES c1c(cc2c(c(NC(C)CCCN(C(C)=O)CC)ccn2)c1)Cl
SPLASH splash10-0api-2292000000-1371925c40b62c712c05
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.
Sample Preparation Procedure Detected: U+UHYAC
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_1759