ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000480
RECORD_TITLE: 1-METHYLPIPERIDINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: 1-METHYLPIPERIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₃N
CH$EXACT_MASS: 99.10480
CH$SMILES: CN(C1)CCCC1
CH$IUPAC: InChI=1S/C6H13N/c1-7-5-3-2-4-6-7/h2-6H2,1H3
CH$LINK: INCHIKEY PAMIQIKDUOTOBW-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8060822

AC$INSTRUMENT: MX-1303
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 50 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0005-9000000000-697070a6503037b00a5a
PK$NUM_PEAK: 38
PK$PEAK: m/z int. rel.int.
  26 4.7 47
  27 18.1 181
  29 10.9 109
  30 0.81 8
  38 1.7 17
  39 15.3 153
  40 3.3 33
  41 2.08 21
  42 62 620
  43 70 700
  45 1.2 12
  50 0.12 1
  51 1.8 18
  52 1.8 18
  53 3.6 36
  54 0.51 5
  55 12.3 123
  56 12.7 127
  57 18.6 186
  58 1.81 18
  59 1.1 11
  67 2.5 25
  68 4.5 45
  69 0.24 2
  70 31 310
  71 12 120
  80 2.2 22
  81 0.16 2
  82 3.9 39
  83 2 20
  84 23.5 235
  85 0.71 7
  85.5 2.9 29
  96 4.8 48
  97 2.4 24
  98 99.99 999
  99 40 400
  100 3.2 32
//