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Maraviroc artifact ME
SpectraBase Compound ID IgovlxHX9og
InChI InChI=1S/C7H13N3/c1-5(2)7-9-8-6(3)10(7)4/h5H,1-4H3
InChIKey MKJBNVQUEYURRQ-UHFFFAOYSA-N
Mol Weight 139.2 g/mol
Molecular Formula C7H13N3
Exact Mass 139.110947 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FfgEPz13PMy
Name Maraviroc artifact ME
Classification Virustatic
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Exact Mass 139.110947431 u
Formula C7H13N3
InChI InChI=1S/C7H13N3/c1-5(2)7-9-8-6(3)10(7)4/h5H,1-4H3
InChIKey MKJBNVQUEYURRQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 139.202 g/mol
SMILES C[n]1c(nnc1C(C)C)C
SPLASH splash10-00di-5900000000-c58b0d53b65a08e29beb
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 Maraviroc artifact (isopropylmethyltriazole) ME
Technique GC/MS
Wiley ID MMPW6e_7910