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Ritonavir artifact-1
SpectraBase Compound ID DVEdII4LvN9
InChI InChI=1S/C4H5NOS/c6-3-4-5-1-2-7-4/h1-2,6H,3H2
InChIKey JNHDLNXNYPLBMJ-UHFFFAOYSA-N
Mol Weight 115.15 g/mol
Molecular Formula C4H5NOS
Exact Mass 115.009185 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3otfkuKKWG
Name Ritonavir artifact-1
Classification Virustatic
Comments Original RI info: <1000
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Exact Mass 115.009184958 u
Formula C4H5NOS
InChI InChI=1S/C4H5NOS/c6-3-4-5-1-2-7-4/h1-2,6H,3H2
InChIKey JNHDLNXNYPLBMJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 115.150 g/mol
Related CAS Registry Number(s) 155213-67-5
SMILES c1nc(sc1)CO
SPLASH splash10-052r-9200000000-9a471150098e408cab92
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 Ritonavir artifact (hydroxymethylthiazole)
Technique GC/MS
Wiley ID MMPW6e_7927