ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007110
RECORD_TITLE: ISOBUTYL ALCOHOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: ISOBUTYL ALCOHOL
CH$NAME: 2-METHYL-1-PROPANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₄H₁₀O
CH$EXACT_MASS: 74.07316
CH$SMILES: OCC(C)C
CH$IUPAC: InChI=1S/C4H10O/c1-4(2)3-5/h4-5H,3H2,1-2H3
CH$LINK: CAS 78-83-1
CH$LINK: INCHIKEY ZXEKIIBDNHEJCQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0021759

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$SPLASH: splash10-0006-9000000000-a022508915e78517db51
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  15 4.19 42
  26 3.72 37
  27 35.98 360
  28 4.2 42
  29 17.83 178
  30 1.33 13
  31 54.88 549
  32 1.2 12
  33 49.19 492
  37 1.42 14
  38 3.87 39
  39 22.24 222
  40 4.29 43
  41 63.19 632
  42 59.12 591
  43 99.99 999
  44 3.42 34
  45 3.08 31
  53 1.03 10
  55 5.8 58
  56 4.27 43
  57 5.25 53
  59 3.77 38
  73 1.59 16
  74 10.1 101
//