ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011778
RECORD_TITLE: BENZYL BROMIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: BENZYL BROMIDE
CH$NAME: ALPHA-BROMOTOLUENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₇Br
CH$EXACT_MASS: 169.97311
CH$SMILES: BrCc(c1)cccc1
CH$IUPAC: InChI=1S/C7H7Br/c8-6-7-4-2-1-3-5-7/h1-5H,6H2
CH$LINK: COMPTOX DTXSID8024658
CH$LINK: INCHIKEY AGEZXYOZHKGVCM-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:7498

AC$INSTRUMENT: HITACHI M-80A
AC$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$SPLASH: splash10-0006-9100000000-c48b5a5fb4ea89f4c580
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
  26 1.01 10
  27 1.7 17
  37 1.16 12
  38 4.25 43
  39 16.74 167
  40 1.91 19
  41 3.92 39
  50 6.83 68
  51 9.83 98
  52 4.5 45
  61 1.86 19
  62 5.73 57
  63 16.6 166
  64 6.23 62
  65 35.42 354
  66 1.71 17
  79 2.5 25
  81 3.27 33
  86 1.42 14
  89 14.83 148
  90 8.25 83
  91 99.99 999
  92 17.9 179
  170 15.9 159
  171 1.27 13
  172 15.16 152
  173 1.2 12
//