ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011892
RECORD_TITLE: 4-AMINOBUTYRIC ACID; 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$NAME: 4-AMINOBUTYRIC ACID
CH$NAME: GAMMA-AMINOBUTYRIC ACID
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₄H₉NO₂
CH$EXACT_MASS: 103.06333
CH$SMILES: NCCCC(O)=O
CH$IUPAC: InChI=1S/C4H9NO2/c5-3-1-2-4(6)7/h1-3,5H2,(H,6,7)
CH$LINK: CAS 56-12-2
CH$LINK: NIKKAJI J1.375G
CH$LINK: INCHIKEY BTCSSZJGUNDROE-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6035106

AC$INSTRUMENT: HITACHI M-2500
AC$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$SPLASH: splash10-001i-9000000000-21ea76dfb0da62031f1d
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  15 1.11 11
  17 1.25 13
  18 4.62 46
  26 2.3 23
  27 6.17 62
  28 17.5 175
  29 3.86 39
  30 99.99 999
  31 2.28 23
  39 3.9 39
  40 1.09 11
  41 6.87 69
  42 6.13 61
  43 12.86 129
  44 7.65 77
  45 5.72 57
  54 1.28 13
  55 1.57 16
  56 7.51 75
  57 1.21 12
  69 1.73 17
  84 2.28 23
  85 1.3 13
  86 1.5 15
  103 3.91 39
//