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Oxymetazoline
SpectraBase Compound ID 5cY8IxhMuBa
InChI InChI=1S/C16H24N2O/c1-10-8-13(16(3,4)5)15(19)11(2)12(10)9-14-17-6-7-18-14/h8,19H,6-7,9H2,1-5H3,(H,17,18)
InChIKey WYWIFABBXFUGLM-UHFFFAOYSA-N
Mol Weight 260.38 g/mol
Molecular Formula C16H24N2O
Exact Mass 260.188863 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID 8yzoRCHYm0
Name Oxymetazoline MS2
CAS Registry Number 1491-59-4
Comments F: ITMS + c ESI d w Full ms2 261.10
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Formula C16H24N2O
InChI InChI=1S/C16H24N2O/c1-10-8-13(16(3,4)5)15(19)11(2)12(10)9-14-17-6-7-18-14/h8,19H,6-7,9H2,1-5H3,(H,17,18)
InChIKey WYWIFABBXFUGLM-UHFFFAOYSA-N
Ion Polarity P
Ionization Type ESI
SMILES OC=1C(=C(CC2=NCCN2)C(=CC1C(C)(C)C)C)C
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: Parent
Source of Spectrum Maurer/Wissenbach/Weber, Saarland University
Spectrum Type ms2
Technique ITMS