ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006463
RECORD_TITLE: ISOBUTYL 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$NAME: ISOBUTYL FORMATE
CH$NAME: 2-METHYLPROPYL FORMATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₅H₁₀O₂
CH$EXACT_MASS: 102.06808
CH$SMILES: O=COCC(C)C
CH$IUPAC: InChI=1S/C5H10O2/c1-5(2)3-7-4-6/h4-5H,3H2,1-2H3
CH$LINK: INCHIKEY AVMSWPWPYJVYKY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7060257

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$SPLASH: splash10-052f-9000000000-20bd4fc945c5dd133050
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
  26 2.09 21
  27 29.62 296
  28 5.34 53
  29 28.33 283
  30 1.32 13
  31 46.37 464
  32 4.44 44
  33 1.03 10
  38 2.28 23
  40 4.84 48
  41 71.23 712
  42 20.23 202
  43 93.52 935
  44 3.22 32
  45 2.01 20
  53 1.31 13
  55 8.19 82
  56 99.99 999
  57 9.93 99
  59 8.5 85
  60 46.94 469
  61 13.47 135
  73 1.41 14
//