ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005862
RECORD_TITLE: BETA-PHENYLETHYLAMINE; 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$NAME: BETA-PHENYLETHYLAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₁N
CH$EXACT_MASS: 121.08915
CH$SMILES: NCCc(c1)cccc1
CH$IUPAC: InChI=1S/C8H11N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7,9H2
CH$LINK: INCHIKEY BHHGXPLMPWCGHP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5058773

AC$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-001i-9000000000-94774bbd6283b4a26a51
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  28 3.39 34
  30 99.99 999
  31 1.69 17
  39 3.81 38
  50 1.27 13
  51 2.33 23
  63 2.12 21
  65 4.87 49
  77 1.91 19
  89 1.27 13
  91 10.8 108
  92 4.24 42
  103 1.48 15
  121 5.3 53
//