ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009791
RECORD_TITLE: 4-(3-METHYL-2-BUTENOXY)-2-METHYL-2-BUTANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: 4-(3-METHYL-2-BUTENOXY)-2-METHYL-2-BUTANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H20O2
CH$EXACT_MASS: 172.14633
CH$SMILES: CC(C)=CCOCCC(C)(C)O
CH$IUPAC: InChI=1S/C10H20O2/c1-9(2)5-7-12-8-6-10(3,4)11/h5,11H,6-8H2,1-4H3
CH$LINK: COMPTOX DTXSID80608205
CH$LINK: INCHIKEY XWKFROPYJWBTBH-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:20504088
AC$INSTRUMENT: JEOL JMS-D-300
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: splash10-014i-9000000000-35cf055e67a342eb266c
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  27 5.8 58
  29 5 50
  39 7 70
  40 0.25 3
  41 60.2 602
  42 8.6 86
  43 7.5 75
  53 0.76 8
  55 17.2 172
  56 4.2 42
  57 6.7 67
  59 1.86 19
  67 10.6 106
  68 14.5 145
  69 99.99 999
  70 3.18 32
  71 31.8 318
  83 5 50
  85 49.8 498
  86 0.64 6
  87 8 80
  89 12.5 125
  96 2.5 25
  139 4.43 44
  140 4.1 41
//
