ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006464
RECORD_TITLE: PENTYL FORMATE; 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$NAME: PENTYL FORMATE
CH$NAME: AMYL FORMATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₂O₂
CH$EXACT_MASS: 116.08373
CH$SMILES: CCCCCOC=O
CH$IUPAC: InChI=1S/C6H12O2/c1-2-3-4-5-8-6-7/h6H,2-5H2,1H3
CH$LINK: INCHIKEY DIQMPQMYFZXDAX-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2047698

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$SPLASH: splash10-002f-9000000000-33963b0f66346230ad8e
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
  15 2.09 21
  26 2.85 29
  27 32.26 323
  28 11.53 115
  29 48.65 487
  30 1.42 14
  31 43.15 432
  38 1.53 15
  39 21.51 215
  40 3.92 39
  41 50.51 505
  42 99.99 999
  43 24.59 246
  44 2.58 26
  45 5.15 52
  47 8.98 90
  53 2.41 24
  54 1.46 15
  55 69.7 697
  56 9.32 93
  57 7.5 75
  59 2.17 22
  69 4.12 41
  70 66.07 661
  71 4.61 46
  73 3 30
  87 5.14 51
//