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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009526

3-CHLORO-2-METHYLPROPENE; EI-B; MS

Mass Spectrum
Chemical Structure
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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009526
RECORD_TITLE: 3-CHLORO-2-METHYLPROPENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NARA WOMEN'S UNIVERSITY
LICENSE: CC BY-NC-SA

CH$NAME: 3-CHLORO-2-METHYLPROPENE
CH$NAME: METHALLYL CHLORIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H7Cl
CH$EXACT_MASS: 90.02363
CH$SMILES: CC(=C)CCl
CH$IUPAC: InChI=1S/C4H7Cl/c1-4(2)3-5/h1,3H2,2H3
CH$LINK: CAS 563-47-3
CH$LINK: INCHIKEY OHXAOPZTJOUYKM-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1020279

AC$INSTRUMENT: HITACHI M-80
AC$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$SPLASH: splash10-000l-9000000000-609b3b297f7f7eaf3ae2
PK$NUM_PEAK: 49
PK$PEAK: m/z int. rel.int.
  12 1.52 15
  13 10.28 103
  14 18.37 184
  15 1.51 15
  24 1.18 12
  25 9.18 92
  26 37.82 378
  27 14.72 147
  28 22.8 228
  32 1.66 17
  35 7.87 79
  36 6.81 68
  37 15.95 160
  38 23.04 230
  39 99.99 999
  40 15.16 152
  41 28.68 287
  42 4.87 49
  43 41.85 419
  47 2.87 29
  48 4.27 43
  49 39.99 400
  50 17.75 178
  51 22.8 228
  52 6.81 68
  53 31.01 310
  54 21.81 218
  55 60.71 607
  56 21.93 219
  57 3.45 35
  58 4.71 47
  61 1.81 18
  62 3.53 35
  63 4.29 43
  64 1.07 11
  65 2.3 23
  67 3.4 34
  68 1.01 10
  73 2.28 23
  75 7.43 74
  77 4.37 44
  79 2.97 30
  81 2.32 23
  89 5.17 52
  90 7.34 73
  91 2.8 28
  92 2.56 26
  93 1.16 12
  95 2.45 25
//

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