ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005944
RECORD_TITLE: 4-METHYLPIPERIDINE; CI-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$NAME: 4-METHYLPIPERIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₃N
CH$EXACT_MASS: 99.10480
CH$SMILES: CC(C1)CCNC1
CH$IUPAC: InChI=1S/C6H13N/c1-6-2-4-7-5-3-6/h6-7H,2-5H2,1H3
CH$LINK: INCHIKEY UZOFELREXGAFOI-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8060820

AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 100 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE

PK$SPLASH: splash10-0002-9100000000-71999ef9c7196c28d1ea
PK$NUM_PEAK: 8
PK$PEAK: m/z int. rel.int.
  70 4.88 49
  71 3.22 32
  82 1.65 17
  85 19.03 190
  98 90.12 901
  99 99.99 999
  100 28.49 285
  101 2.18 22
//