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Ticlopidine-M (N-dealkyl-) AC
SpectraBase Compound ID XePfHedAzB
InChI InChI=1S/C9H11NOS/c1-7(11)10-4-2-9-8(6-10)3-5-12-9/h3,5H,2,4,6H2,1H3
InChIKey DXFQBPYXPWUJRJ-UHFFFAOYSA-N
Mol Weight 181.25 g/mol
Molecular Formula C9H11NOS
Exact Mass 181.056135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gna6JkwzsZz
Name Ticlopidine-M (N-dealkyl-) AC
Classification Thromb.aggr.inhib.
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Exact Mass 181.056135151 u
Formula C9H11NOS
InChI InChI=1S/C9H11NOS/c1-7(11)10-4-2-9-8(6-10)3-5-12-9/h3,5H,2,4,6H2,1H3
InChIKey DXFQBPYXPWUJRJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 181.253 g/mol
SMILES C1c2sccc2CN(C1)C(C)=O
SPLASH splash10-01p9-7900000000-803c7f986f73dea83a8f
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_6474