ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010539
RECORD_TITLE: 2-METHYLBENZOXAZOLE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NARA WOMEN'S UNIVERSITY
LICENSE: CC BY-NC-SA

CH$NAME: 2-METHYLBENZOXAZOLE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₇NO
CH$EXACT_MASS: 133.05276
CH$SMILES: Cc(n1)oc(c2)c(ccc2)1
CH$IUPAC: InChI=1S/C8H7NO/c1-6-9-7-4-2-3-5-8(7)10-6/h2-5H,1H3
CH$LINK: CAS 95-21-6
CH$LINK: INCHIKEY DQSHFKPKFISSNM-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID50870432

AC$INSTRUMENT: HITACHI M-80
AC$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$SPLASH: splash10-001i-8900000000-b666d088b79a32fd2d96
PK$NUM_PEAK: 34
PK$PEAK: m/z int. rel.int.
  15 2.1 21
  26 2.99 30
  27 3.51 35
  38 2.67 27
  39 7.91 79
  40 4.89 49
  42 1.4 14
  43 1.78 18
  44 1.75 18
  51 3.27 33
  52 5.38 54
  53 3.89 39
  54 1.84 18
  61 1.82 18
  62 5.26 53
  63 24.4 244
  64 21.44 214
  65 5.73 57
  66 1.2 12
  75 1 10
  76 1.82 18
  77 3.03 30
  78 14.39 144
  79 3.01 30
  90 1.2 12
  91 1.92 19
  92 8.37 84
  93 3.12 31
  104 14.37 144
  105 15.03 150
  106 1.4 14
  132 3.11 31
  133 99.99 999
  134 9.62 96
//