MassBank Record: JP000964



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

ACCESSION: JP000964
RECORD_TITLE: 4-BROMOPHENYL PHENYL ETHER; 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$NAME: 4-BROMOPHENYL PHENYL ETHER CH$COMPOUND_CLASS: N/A CH$FORMULA: C12H9BrO CH$EXACT_MASS: 247.98368 CH$SMILES: c(c2)ccc(c2)Oc(c1)ccc(Br)c1 CH$IUPAC: InChI=1S/C12H9BrO/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H CH$LINK: CAS 101-55-3
AC$INSTRUMENT: JEOL JMS-01-SG 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: splash10-0f95-9550000000-8818bfd4d6daeeeafd34 PK$NUM_PEAK: 41 PK$PEAK: m/z int. rel.int. 50 24.4 244 51 37.3 373 52 2.4 24 61 0.21 2 62 6.5 65 63 22.5 225 64 9.2 92 65 0.92 9 66 2.9 29 70 5.5 55 74 10.1 101 75 1.68 17 76 17.6 176 77 58.5 585 78 4.3 43 89 0.21 2 92 3.3 33 93 2.1 21 94 3.3 33 115 2.93 29 116 3.2 32 117 3.2 32 119 2.7 27 139 1.31 13 140 3.9 39 141 69.5 695 142 8.7 87 143 0.74 7 145 6.7 67 155 4 40 157 4 40 168 1.46 15 169 12.5 125 172 4.5 45 174 4.3 43 220 0.48 5 222 4.6 46 248 99.99 999 249 14 140 250 8.86 89 251 13.5 135 //