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Efavirenz artifact
SpectraBase Compound ID 28Svob6HIAC
InChI InChI=1S/C13H9ClF3N/c14-9-4-6-12(18)10(7-9)11(13(15,16)17)5-3-8-1-2-8/h4,6-7H,1-2,18H2
InChIKey MSTDDUOKDUIMOE-UHFFFAOYSA-N
Mol Weight 271.67 g/mol
Molecular Formula C13H9ClF3N
Exact Mass 271.037561 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 58D3byc7iC
Name Efavirenz artifact
Classification Virustatic
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Exact Mass 271.037561483 u
Formula C13H9ClF3N
InChI InChI=1S/C13H9ClF3N/c14-9-4-6-12(18)10(7-9)11(13(15,16)17)5-3-8-1-2-8/h4,6-7H,1-2,18H2
InChIKey MSTDDUOKDUIMOE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 271.670 g/mol
SMILES c1cc(cc(c1N)C(=C=C=C1CC1)C(F)(F)F)Cl
SPLASH splash10-00di-2490000000-62cd55b6d795449d4e01
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
Technique GC/MS
Wiley ID MMPW6e_7933