ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003047
RECORD_TITLE: 2,2-DICHLOROPENTANE; 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$NAME: 2,2-DICHLOROPENTANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H10Cl2
CH$EXACT_MASS: 140.01596
CH$SMILES: CCCC(C)(Cl)Cl
CH$IUPAC: InChI=1S/C5H10Cl2/c1-3-4-5(2,6)7/h3-4H2,1-2H3
CH$LINK: INCHIKEY MNXVHBFCELLVBA-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID10188444
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: splash10-00mo-9000000000-d5c578030392182c835d
PK$NUM_PEAK: 85
PK$PEAK: m/z int. rel.int.
  25 0.4 4
  26 6.1 61
  27 41.8 418
  28 0.94 9
  29 18.3 183
  30 0.5 5
  31 1.4 14
  32 0.19 2
  33 0.3 3
  34 0.1 1
  35 1.3 13
  36 0.47 5
  37 2.9 29
  38 6.2 62
  39 33.1 331
  40 0.73 7
  41 75.3 753
  42 11.7 117
  43 86.6 866
  44 0.32 3
  47 0.4 4
  48 0.2 2
  49 4.9 49
  50 0.03 0
  51 6.3 63
  52 1.7 17
  53 21.7 217
  54 0.17 2
  55 5.6 56
  56 0.3 3
  57 0.5 5
  58 0.06 1
  59 0.2 2
  60 0.8 8
  61 6.7 67
  62 0.25 3
  63 16 160
  64 1 10
  65 5.4 54
  66 0.07 1
  67 4.6 46
  68 1.2 12
  69 99.99 999
  70 0.59 6
  71 0.4 4
  72 0.2 2
  73 1 10
  74 0.03 0
  75 4.8 48
  76 34.1 341
  77 3.3 33
  78 1.07 11
  79 0.6 6
  83 1 10
  84 0.2 2
  85 0.06 1
  86 0.3 3
  87 0.5 5
  88 0.2 2
  89 0.13 1
  90 0.6 6
  91 4.5 45
  92 0.9 9
  93 0.01 0
  94 0.2 2
  96 1.9 19
  97 8.7 87
  98 0.14 1
  99 5.3 53
  100 0.4 4
  101 0.9 9
  102 0.01 0
  103 0.9 9
  104 11.5 115
  105 27.2 272
  106 0.51 5
  107 8.7 87
  108 0.4 4
  109 0.2 2
  110 0.04 0
  111 0.8 8
  112 0.3 3
  113 0.4 4
  114 0.01 0
  115 0.1 1
//
