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Fenbutrazate-M (ester cleveage) MS2
SpectraBase Compound ID 6XUOVndcPSF
InChI InChI=1S/C13H19NO2/c1-11-13(12-5-3-2-4-6-12)16-10-8-14(11)7-9-15/h2-6,11,13,15H,7-10H2,1H3
InChIKey OGLFOMZDOZNYSY-UHFFFAOYSA-N
Mol Weight 221.3 g/mol
Molecular Formula C13H19NO2
Exact Mass 221.141579 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID EJTGfAZKb6E
Name Fenbutrazate-M (ester cleveage)
Collision Gas N2
Comments FTMS + p ESI d Full ms2 [email protected] [50.00-245.00]
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Formula C13H19NO2
InChI InChI=1S/C13H19NO2/c1-11-13(12-5-3-2-4-6-12)16-10-8-14(11)7-9-15/h2-6,11,13,15H,7-10H2,1H3
InChIKey OGLFOMZDOZNYSY-UHFFFAOYSA-N
Inlet Type UHPLC
Instrument Name Thermo Fisher Q Exactive Orbitrap
Ion Polarity P
Ionization Type HESI
Precursor Ion [M+H]+
SMILES OCCN1C(C(OCC1)C1=CC=CC=C1)C
Sample Comments The MMHW Reference Handbook is attached to Record #1, under the Attachments tab. Refer to this reference for the sample preparation procedure and abbreviations, as well as other relevant information pertaining to this database.
Selected Ion Charge 1
Source of Spectrum Maurer/Meyer/Helfer/Weber c/o Saarland University Homburg/Saar
Spectrum Type ms2
Technique HCD