##TITLE= C11H8N2O - 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= 18 ##MAXY= 100 ##MINY= 0 ##$Unsaturation=9.0 ##$Molecular weight=184.19732 ##$Resolution=0.001 ##$Threshold=1.0E-5 ##$Monoisotopic mass=184.063663 ##PEAK TABLE= (XY..XY) 182.064, 0 184.064, 100 185.061, 0.7427482 185.067, 12.2345804 185.068, 0.0400962 185.07, 0.120018 186.058, 0.0013792 186.064, 0.0908721 186.068, 0.2004812 186.07, 0.6803862 186.071, 0.0049056 186.073, 0.0146837 187.065, 0.0014891 187.067, 0.0050536 187.071, 0.024528 187.074, 0.0227025 188.075, 0.001364 190.075, 0 ##END=