ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006554
RECORD_TITLE: 2-METHYLPENTANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, CHEMICAL RESEARCH INSTITUTE OF NON-AQUEOUSSOLUTIONS TOHOKU UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 2-METHYLPENTANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₄O
CH$EXACT_MASS: 102.10447
CH$SMILES: CCCC(C)CO
CH$IUPAC: InChI=1S/C6H14O/c1-3-4-6(2)5-7/h6-7H,3-5H2,1-2H3
CH$LINK: INCHIKEY PFNHSEQQEPMLNI-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9026714

AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-0006-9000000000-3815219f065b85e40e84
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
  15 1.54 15
  26 1.21 12
  27 21.04 210
  28 1.94 19
  29 22.05 221
  31 22.68 227
  39 15.18 152
  40 2.07 21
  41 34.73 347
  42 19.27 193
  43 99.99 999
  44 3.05 31
  45 3.42 34
  53 1.83 18
  55 24.8 248
  56 16.51 165
  57 3.64 36
  59 1.37 14
  69 18.51 185
  70 25.42 254
  71 28.08 281
  72 1.27 13
  84 10.84 108
//