##TITLE= C11H14O - resolution: 0.001 ##JCAMP-DX= 5.00 ##DATA TYPE= MASS SPECTRUM ##DATA CLASS= PEAK TABLE ##ORIGIN= Generated spectrum based on ChemCalc www.chemcalc.org ##SPECTROMETER/DATA SYSTEM= Based on ChemCalc isotopic distribution calculator ##XUNITS= M/Z ##YUNITS= RELATIVE ABUNDANCE ##NPOINTS= 14 ##MAXY= 100 ##MINY= 0 ##$Unsaturation=5.0 ##$Molecular weight=162.22867 ##$Resolution=0.001 ##$Threshold=1.0E-5 ##$Monoisotopic mass=162.1044650686 ##PEAK TABLE= (XY..XY) 160.104, 0 162.104, 100 163.108, 11.8973 163.109, 0.03809 163.111, 0.16102 164.109, 0.2055 164.111, 0.64339 164.112, 0.00453 164.114, 0.01916 165.112, 0.02445 165.115, 0.02088 165.117, 0.00104 166.115, 0.00132 168.115, 0 ##END=