MassBank Record: JP000020



 3-METHYLPHENOL; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000020
RECORD_TITLE: 3-METHYLPHENOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA

CH$NAME: 3-METHYLPHENOL CH$COMPOUND_CLASS: N/A CH$FORMULA: C7H8O CH$EXACT_MASS: 108.05751 CH$SMILES: Cc(c1)cc(O)cc1 CH$IUPAC: InChI=1S/C7H8O/c1-6-3-2-4-7(8)5-6/h2-5,8H,1H3
AC$INSTRUMENT: VARIAN MAT-44 AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0a4i-6900000000-f2082b2d78602454887c PK$NUM_PEAK: 20 PK$PEAK: m/z int. rel.int. 51 10.17 102 52 5.37 54 53 11.55 116 54 5.21 52 55 2.97 30 62 2.64 26 63 5.48 55 65 3.6 36 66 2.08 21 77 28.04 280 78 6.84 68 79 32.64 326 80 12.23 122 89 4.79 48 90 11.68 117 91 6 60 106 4.68 47 107 96.34 963 108 99.99 999 109 7.54 75 //