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Mebeverine-M (O-demethyl-alcohol) MS2
SpectraBase Compound ID I2P4yhhT0An
InChI InChI=1S/C15H25NO2/c1-3-16(10-4-5-11-17)13(2)12-14-6-8-15(18)9-7-14/h6-9,13,17-18H,3-5,10-12H2,1-2H3
InChIKey RNGYIAYXMHMWTO-UHFFFAOYSA-N
Mol Weight 251.37 g/mol
Molecular Formula C15H25NO2
Exact Mass 251.188529 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID AasXKYgisqy
Name Mebeverine-M (O-demethyl-alcohol-)
Collision Gas N2
Comments FTMS + p ESI d Full ms2 [email protected] [50.00-275.00]
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Formula C15H25NO2
InChI InChI=1S/C15H25NO2/c1-3-16(10-4-5-11-17)13(2)12-14-6-8-15(18)9-7-14/h6-9,13,17-18H,3-5,10-12H2,1-2H3
InChIKey RNGYIAYXMHMWTO-UHFFFAOYSA-N
Inlet Type UHPLC
Instrument Name Thermo Fisher Q Exactive Orbitrap
Ion Polarity P
Ionization Type HESI
Precursor Ion [M+H]+
SMILES OCCCCN(C(CC1=CC=C(C=C1)O)C)CC
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