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Mebendazole artifact (amine) 3ME
SpectraBase Compound ID LZB7Ek4vsjW
InChI InChI=1S/C17H17N3O/c1-19(2)17-18-14-11-13(9-10-15(14)20(17)3)16(21)12-7-5-4-6-8-12/h4-11H,1-3H3
InChIKey ZRYVLQLAMHZGMX-UHFFFAOYSA-N
Mol Weight 279.34 g/mol
Molecular Formula C17H17N3O
Exact Mass 279.137162 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gip16Se6jvx
Name Mebendazole artifact (amine) 3ME
Classification Anthelmintic
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Exact Mass 279.137162178 u
Formula C17H17N3O
InChI InChI=1S/C17H17N3O/c1-19(2)17-18-14-11-13(9-10-15(14)20(17)3)16(21)12-7-5-4-6-8-12/h4-11H,1-3H3
InChIKey ZRYVLQLAMHZGMX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 279.343 g/mol
SMILES c1ccc(C(=O)c2ccc3c(c2)nc([n]3C)N(C)C)cc1
SPLASH splash10-004i-1290000000-257dbf141575795bc5cf
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_7543