MassBank Record: JP008335



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

ACCESSION: JP008335
RECORD_TITLE: ORTHO-CHLOROPHENOL; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: , UBE SCIENTIFIC ANALYSIS LABORATORY
LICENSE: CC BY-NC-SA

CH$NAME: ORTHO-CHLOROPHENOL CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H5ClO CH$EXACT_MASS: 128.00289 CH$SMILES: Oc(c1)c(Cl)ccc1 CH$IUPAC: InChI=1S/C6H5ClO/c7-5-3-1-2-4-6(5)8/h1-4,8H CH$LINK: INCHIKEY ISPYQTSUDJAMAB-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID5021544
AC$INSTRUMENT: HITACHI M-60 AC$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$SPLASH: splash10-01t9-9600000000-36ba32f2c81fdba5c49c PK$NUM_PEAK: 43 PK$PEAK: m/z int. rel.int. 14 6.19 62 26 2.11 21 27 1.28 13 31 2.07 21 32 3.08 31 37 3.69 37 38 12.09 121 39 14.47 145 41 3.43 34 46 3.3 33 50 6.82 68 51 3.44 34 52 0.72 7 53 2.68 27 54 3.79 38 61 3.92 39 62 7.04 70 63 23.28 233 64 52.33 523 65 18.48 185 70 2.4 24 71 0.34 3 73 5.98 60 75 3.91 39 82 0.53 5 85 0.35 4 87 1.42 14 88 1.54 15 89 0.82 8 92 21.41 214 97 1.54 15 99 4.61 46 100 3.23 32 108 3.67 37 109 0.77 8 111 1.38 14 115 0.57 6 128 99.99 999 129 8.23 82 130 39.56 396 131 2.73 27 142 0.44 4 149 0.41 4 //

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