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Clenbuterol-M (HO-aryl) MS3_1
SpectraBase Compound ID LXuJ4q1M8r0
InChI InChI=1S/C8H8Cl2N2O/c9-5-3-4(1-2-11)8(13)6(10)7(5)12/h1,3H,2,11-12H2/p+1
InChIKey MXOXPMGDKCSEJT-UHFFFAOYSA-O
Mol Weight 220.08 g/mol
Molecular Formula C8H9Cl2N2O
Exact Mass 219.009193 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID HAkP1gIK01K
Name Clenbuterol-M (HO-aryl) MS3_1
Comments T: ITMS + c ESI d w Full ms3 [email protected] [email protected] [50.00-230.00]
Copyright Copyright © 2018-2025 Wiley-VCH GmbH. All Rights Reserved.
InChI InChI=1S/C8H8Cl2N2O/c9-5-3-4(1-2-11)8(13)6(10)7(5)12/h1,3H,2,11-12H2/p+1
InChIKey MXOXPMGDKCSEJT-UHFFFAOYSA-O
Ion Polarity P
Ionization Type ESI
SMILES NC[CH+]C=1C=C(C(=C(C1O)Cl)N)Cl
Sample Comments The MWW Reference Handbook and associated table are attached to Record #1, under the Attachments tab. Refer to these references for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Sample Description Analyte Type: Metabolite
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms3
Technique ITMS