ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010001
RECORD_TITLE: 4-METHYL-2-PIPERIDONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: 4-METHYL-2-PIPERIDONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₁NO
CH$EXACT_MASS: 113.08406
CH$SMILES: CC(C1)CC(=O)NC1
CH$IUPAC: InChI=1S/C6H11NO/c1-5-2-3-7-6(8)4-5/h5H,2-4H2,1H3,(H,7,8)
CH$LINK: INCHIKEY PTSGHGGLRADEFP-UHFFFAOYSA-N

AC$INSTRUMENT: JEOL JMS-D-300
AC$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$SPLASH: splash10-08fu-9300000000-665a40c8b470d06b3db4
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
  27 12.2 122
  28 10.4 104
  29 10.4 104
  30 4.2 42
  31 6.8 68
  39 16.4 164
  40 5.3 53
  41 4.98 50
  42 46.1 461
  43 35.5 355
  44 4.5 45
  45 0.28 3
  53 4.8 48
  54 4.5 45
  55 43.4 434
  56 5.01 50
  57 20.1 201
  58 4.9 49
  67 3 30
  68 0.88 9
  69 29 290
  70 7.8 78
  71 16.6 166
  72 0.3 3
  83 5.6 56
  84 9.1 91
  85 14.4 144
  96 0.7 7
  98 3.2 32
  112 17.4 174
  113 99.99 999
  114 9.5 95
//