MassBank Record: JP001145



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

ACCESSION: JP001145
RECORD_TITLE: PARA-CRESOL METHYL ETHER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NAKAYAMA M, MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: PARA-CRESOL METHYL ETHER CH$NAME: METHYL PARA-TOLYL ETHER CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H10O CH$EXACT_MASS: 122.07316 CH$SMILES: COc(c1)ccc(C)c1 CH$IUPAC: InChI=1S/C8H10O/c1-7-3-5-8(9-2)6-4-7/h3-6H,1-2H3
AC$INSTRUMENT: HITACHI RMS-4 AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 80 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-00b9-9200000000-ee4dedd83fa13835a843 PK$NUM_PEAK: 58 PK$PEAK: m/z int. rel.int. 15 18.5 185 16 3.1 31 17 10.3 103 18 26.7 267 25 3.1 31 26 13.3 133 27 56.4 564 28 18.5 185 29 5.6 56 30 2.6 26 31 2 20 32 4.6 46 37 7.7 77 38 15.4 154 39 52.3 523 40 5.1 51 41 9.2 92 42 3.1 31 43 4.6 46 49 4.6 46 50 23.6 236 51 42.1 421 52 25.2 252 53 19 190 54 2.6 26 55 3.1 31 57 2 20 59 3.1 31 61 5.1 51 62 8.7 87 63 16.9 169 64 5.1 51 65 19.5 195 66 2.6 26 67 2 20 74 4.1 41 75 3.1 31 76 2.6 26 77 78.4 784 78 24.1 241 79 51.8 518 80 4.6 46 81 2 20 89 4.6 46 90 4.6 46 91 30.2 302 92 13.3 133 93 4.6 46 94 2 20 105 2.6 26 106 2.6 26 107 40.6 406 108 10.8 108 109 2.6 26 120 2 20 121 37.4 374 122 99.99 999 123 10.8 108 //