ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011069
RECORD_TITLE: 4-METHOXYBENZYLAMINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 4-METHOXYBENZYLAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₁NO
CH$EXACT_MASS: 137.08406
CH$SMILES: NCc(c1)ccc(OC)c1
CH$IUPAC: InChI=1S/C8H11NO/c1-10-8-4-2-7(6-9)3-5-8/h2-5H,6,9H2,1H3
CH$LINK: CAS 2393-23-9
CH$LINK: INCHIKEY IDPURXSQCKYKIJ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2062371

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$SPLASH: splash10-000i-4900000000-e341129c12366841e06f
PK$NUM_PEAK: 43
PK$PEAK: m/z int. rel.int.
  15 6.3 63
  26 1.01 10
  27 1.43 14
  29 2.39 24
  30 22.41 224
  37 1.05 11
  38 3.33 33
  39 9.9 99
  41 2.4 24
  50 6.76 68
  51 10.22 102
  52 4.67 47
  53 2.05 21
  54 1.57 16
  62 3.05 31
  63 9.01 90
  64 6.31 63
  65 10.27 103
  66 8.65 87
  67 4.92 49
  74 2.15 22
  75 1.54 15
  76 2.45 25
  77 19.74 197
  78 13.1 131
  79 5.35 54
  89 4.95 50
  90 1.5 15
  104 5.18 52
  105 5.16 52
  106 40.98 410
  107 4.73 47
  108 7.94 79
  109 19.11 191
  110 1.64 16
  119 4.12 41
  120 10.29 103
  121 40.02 400
  122 10.9 109
  134 3.04 30
  136 99.99 999
  137 62.87 629
  138 5.63 56
//