MassBank Record: JP001143



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

ACCESSION: JP001143
RECORD_TITLE: META-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$NAME: META-CRESOL METHYL ETHER CH$NAME: METHYL META-TOLYL ETHER CH$COMPOUND_CLASS: N/A CH$FORMULA: C8H10O CH$EXACT_MASS: 122.07316 CH$SMILES: COc(c1)cc(C)cc1 CH$IUPAC: InChI=1S/C8H10O/c1-7-4-3-5-8(6-7)9-2/h3-6H,1-2H3
AC$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: splash10-004i-9100000000-ddc9a8cae4d782dc6ce9 PK$NUM_PEAK: 56 PK$PEAK: m/z int. rel.int. 15 16.5 165 16 6.1 61 17 12.8 128 18 32.9 329 26 7.9 79 27 41.3 413 28 60.4 604 29 5.7 57 30 2.4 24 31 3 30 32 12.8 128 37 9.8 98 38 21.4 214 39 81.7 817 40 6.7 67 41 9.2 92 42 2.4 24 43 3.7 37 44 4.9 49 45 2.4 24 49 3.7 37 50 20.4 204 51 36.6 366 52 23.8 238 53 19.5 195 54 2.4 24 55 3 30 61 4.3 43 62 8.5 85 63 18.9 189 64 6.7 67 65 26.2 262 66 6.7 67 67 2.4 24 73 2.4 24 74 4.3 43 75 3.7 37 76 3.7 37 77 70.7 707 78 21.4 214 79 55 550 80 6.7 67 81 2.4 24 89 5.5 55 90 4.3 43 91 58.5 585 92 30.3 303 93 9.8 98 94 1.8 18 105 2.4 24 106 2.4 24 107 25 250 108 8.5 85 121 15.2 152 122 99.99 999 123 9.2 92 //