ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003684
RECORD_TITLE: 2-HYDROXYMETHYL-1,3-DIMETHOXY-2-METHYLPROPANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA
CH$NAME: 2-HYDROXYMETHYL-1,3-DIMETHOXY-2-METHYLPROPANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H16O3
CH$EXACT_MASS: 148.10994
CH$SMILES: COCC(C)(CO)COC
CH$IUPAC: InChI=1S/C7H16O3/c1-7(4-8,5-9-2)6-10-3/h8H,4-6H2,1-3H3
CH$LINK: INCHIKEY GJDPWHURBFNYAV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID70337390
AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0072-9000000000-fcdb258b923fae03286f
PK$NUM_PEAK: 50
PK$PEAK: m/z int. rel.int.
  38 0.5 5
  39 8.3 83
  41 21.4 214
  42 0.39 4
  43 10.3 103
  45 99.99 999
  46 2.4 24
  47 0.17 2
  53 3.2 32
  54 3.2 32
  55 20.3 203
  56 3.28 33
  57 19.2 192
  58 4.3 43
  59 3.9 39
  60 0.03 0
  61 31 310
  62 0.6 6
  67 1.2 12
  68 0.04 0
  69 3.9 39
  70 2.4 24
  71 51.9 519
  72 0.82 8
  73 4.3 43
  74 0.3 3
  75 27.8 278
  76 0.07 1
  77 0.1 1
  82 0.2 2
  83 2.8 28
  84 0.71 7
  85 32.8 328
  86 19.3 193
  87 3.8 38
  88 0.03 0
  91 0.2 2
  93 0.3 3
  95 0.1 1
  97 0.02 0
  98 1.4 14
  99 0.8 8
  100 0.2 2
  101 0.19 2
  102 0.2 2
  103 0.3 3
  115 0.3 3
  116 0.05 1
  117 0.2 2
  118 0.3 3
//
