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Zofenopril artifact MEAC      @
SpectraBase Compound ID 8ObtuMpJzZV
InChI InChI=1S/C18H23NO4S2/c1-12(11-24-13(2)20)17(21)19-10-9-15(16(19)18(22)23-3)25-14-7-5-4-6-8-14/h4-8,12,15-16H,9-11H2,1-3H3
InChIKey OERFTYAOCDONHE-UHFFFAOYSA-N
Mol Weight 381.51 g/mol
Molecular Formula C18H23NO4S2
Exact Mass 381.106851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DJGa6YZ7Zy7
Name Zofenopril artifact MEAC @
Classification ACE inhibitor
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Exact Mass 381.106850569 u
Formula C18H23NO4S2
InChI InChI=1S/C18H23NO4S2/c1-12(11-24-13(2)20)17(21)19-10-9-15(16(19)18(22)23-3)25-14-7-5-4-6-8-14/h4-8,12,15-16H,9-11H2,1-3H3
InChIKey OERFTYAOCDONHE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 381.505 g/mol
Related CAS Registry Number(s) 81872-10-8
SMILES c1ccccc1SC1CCN(C1C(OC)=O)C(C(CSC(C)=O)C)=O
SPLASH splash10-016r-8920000000-b325bd41669df4453892
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
Synonyms Zofenopril artifact (debenzoyl-) MEAC Zofenoprilate artifact (debenzoyl-) MEAC
Technique GC/MS
Wiley ID MMPW6e_8372