ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006395
RECORD_TITLE: AMYL PROPIONATE; 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$NAME: AMYL PROPIONATE
CH$NAME: PENTYL PROPIONATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₆O₂
CH$EXACT_MASS: 144.11503
CH$SMILES: CCCCCOC(=O)CC
CH$IUPAC: InChI=1S/C8H16O2/c1-3-5-6-7-10-8(9)4-2/h3-7H2,1-2H3
CH$LINK: INCHIKEY TWSRVQVEYJNFKQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4041606

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$SPLASH: splash10-0a6u-9000000000-11533b789e166ead320a
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  26 2 20
  27 23.01 230
  28 8.14 81
  29 53.27 533
  30 1.46 15
  31 2.75 28
  39 8.2 82
  40 1.51 15
  41 18.76 188
  42 24.75 248
  43 28.54 285
  44 1.15 12
  55 20.44 204
  56 2.83 28
  57 99.99 999
  58 3.14 31
  69 6.04 60
  70 41.49 415
  71 5.84 58
  72 1.59 16
  74 2.46 25
  75 38.96 390
  76 1.16 12
  85 1.69 17
  87 6.93 69
  115 1.12 11
//