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Delavirdine artifact (indole) AC
SpectraBase Compound ID Ejcsyl8yMLN
InChI InChI=1S/C11H12N2O3S/c1-8(14)13-6-5-9-7-10(3-4-11(9)13)12-17(2,15)16/h3-7,12H,1-2H3
InChIKey RKFDXSFVGPNCRE-UHFFFAOYSA-N
Mol Weight 252.29 g/mol
Molecular Formula C11H12N2O3S
Exact Mass 252.056863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4F3nfWxHzk
Name Delavirdine artifact (indole) AC
Classification Virustatic
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Exact Mass 252.056863425 u
Formula C11H12N2O3S
InChI InChI=1S/C11H12N2O3S/c1-8(14)13-6-5-9-7-10(3-4-11(9)13)12-17(2,15)16/h3-7,12H,1-2H3
InChIKey RKFDXSFVGPNCRE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 252.288 g/mol
SMILES c1(cc2cc[n](c2cc1)C(C)=O)NS(=O)(=O)C
SPLASH splash10-001i-2910000000-b8cd04c8189655780b52
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 Delavirdine artifact (indole part) AC
Technique GC/MS
Wiley ID MMPW6e_9415