MassBank Record: JP000016



 2,3-DIMETHYLPHENOL; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000016
RECORD_TITLE: 2,3-DIMETHYLPHENOL; 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$NAME: 2,3-DIMETHYLPHENOL CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H10O CH$EXACT_MASS: 122.07316 CH$SMILES: Cc(c1)c(C)c(O)cc1 CH$IUPAC: InChI=1S/C8H10O/c1-6-4-3-5-8(9)7(6)2/h3-5,9H,1-2H3
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$SPLASH: splash10-0adi-6900000000-3ac5300f3e71fb52e12d PK$NUM_PEAK: 31 PK$PEAK: m/z int. rel.int. 51 12.91 129 52 4.92 49 53 8.31 83 55 3.21 32 60 4.8 48 61 2.86 29 62 3.03 30 63 5.14 51 64 2.25 23 65 7.71 77 66 2.24 22 76 5.19 52 77 33.89 339 78 14.56 146 79 22.68 227 80 2.23 22 90 2.31 23 91 19.07 191 92 2.93 29 93 5.67 57 94 4.88 49 102 2.13 21 103 6.96 70 104 4.11 41 105 2.52 25 106 14.96 150 107 99.99 999 108 7.75 78 120 35.03 350 122 66.39 664 123 6.35 64 //