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Mebendazole artifact isomer-1 2ME
SpectraBase Compound ID 2M1yG9hxXFI
InChI InChI=1S/C16H15N3O/c1-19(2)16-17-13-9-8-12(10-14(13)18-16)15(20)11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,18)
InChIKey PDVVXIKUZLATQR-UHFFFAOYSA-N
Mol Weight 265.32 g/mol
Molecular Formula C16H15N3O
Exact Mass 265.121512 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1wdeK2yMUa
Name Mebendazole artifact isomer-1 2ME
Classification Anthelmintic
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Exact Mass 265.121512114 u
Formula C16H15N3O
InChI InChI=1S/C16H15N3O/c1-19(2)16-17-13-9-8-12(10-14(13)18-16)15(20)11-6-4-3-5-7-11/h3-10H,1-2H3,(H,17,18)
InChIKey PDVVXIKUZLATQR-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 265.316 g/mol
SMILES c1ccc(C(=O)c2cc3c(cc2)[nH]c(n3)N(C)C)cc1
SPLASH splash10-014i-1690000000-58b417b7049c4657d6c9
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 Mebendazole artifact (amine) isomer-1 2ME
Technique GC/MS
Wiley ID MMPW6e_7542