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Xylometazoline
SpectraBase Compound ID I8RqUkfKNfY
InChI InChI=1S/C16H24N2/c1-11-8-13(16(3,4)5)9-12(2)14(11)10-15-17-6-7-18-15/h8-9H,6-7,10H2,1-5H3,(H,17,18)
InChIKey HUCJFAOMUPXHDK-UHFFFAOYSA-N
Mol Weight 244.38 g/mol
Molecular Formula C16H24N2
Exact Mass 244.193949 g/mol

Mass Spectrum (LC)

Mass Spectrum (LC)

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SpectraBase Spectrum ID EeCBRBciSxi
Name Xylometazoline
CAS Registry Number 526-36-3
Collision Energy 20 eV
Copyright Copyright © 2012-2025 Herbert Oberacher. All Rights Reserved.
Exact Mass 244.193948781 u
Formula C16H24N2
InChI InChI=1S/C16H24N2/c1-11-8-13(16(3,4)5)9-12(2)14(11)10-15-17-6-7-18-15/h8-9H,6-7,10H2,1-5H3,(H,17,18)
InChIKey HUCJFAOMUPXHDK-UHFFFAOYSA-N
Instrument Name QStar XL, AB Sciex
Ion Polarity P
Ionization Type ESI+
Molecular Weight 244.382 g/mol
Nominal Mass 244 u
Precursor Ion [M+H]+
Precursor m/z 245.201
SMILES N1CCN=C1CC1=C(C=C(C(C)(C)C)C=C1C)C
Selected Ion Charge 1
Source of Spectrum Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria
Spectrum Type ms2
Synonyms 2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole
Technique Q-TOF
Wiley ID MSforID_+_1011.11