ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008124
RECORD_TITLE: 3-DIMETHYLAMINO-2-METHOXYMETHYL-2-BUTEN-4-OLIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 3-DIMETHYLAMINO-2-METHOXYMETHYL-2-BUTEN-4-OLIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H13NO3
CH$EXACT_MASS: 171.08954
CH$SMILES: COCC(C(=O)1)=C(CO1)N(C)C
CH$IUPAC: InChI=1S/C8H13NO3/c1-9(2)7-5-12-8(10)6(7)4-11-3/h4-5H2,1-3H3
CH$LINK: INCHIKEY RGWNVTBGNOHVBO-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-HX-100
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: splash10-0006-6900000000-9f2ca5802e404aa7f9af
PK$NUM_PEAK: 70
PK$PEAK: m/z int. rel.int.
  39 1.25 13
  40 0.39 4
  41 2.17 22
  42 6.33 63
  43 1.9 19
  44 4.6 46
  45 8.27 83
  46 0.94 9
  52 0.56 6
  53 1.67 17
  54 0.74 7
  55 3.01 30
  56 3.7 37
  57 1.18 12
  58 3.66 37
  61 0.67 7
  66 1.81 18
  67 3.92 39
  68 2.72 27
  69 2.87 29
  70 1.71 17
  71 0.71 7
  72 1.73 17
  73 0.34 3
  74 0.54 5
  79 0.4 4
  80 0.89 9
  81 2.82 28
  82 6.24 62
  83 2.02 20
  84 1.15 12
  85 0.95 10
  86 67.59 676
  87 3.91 39
  88 0.66 7
  94 3.07 31
  95 1.11 11
  96 16.06 161
  97 1.93 19
  98 1.4 14
  99 0.38 4
  108 0.37 4
  109 0.36 4
  110 1.3 13
  111 2.57 26
  112 2.94 29
  113 0.63 6
  115 0.89 9
  116 0.33 3
  118 1.61 16
  122 0.64 6
  124 0.76 8
  126 2.13 21
  127 2.28 23
  128 1.4 14
  129 0.34 3
  138 2.05 21
  139 5.25 53
  140 99.99 999
  141 44.58 446
  142 4.33 43
  143 0.65 7
  149 1.34 13
  154 1.62 16
  156 4.48 45
  157 0.49 5
  170 3.1 31
  171 50.91 509
  172 5.61 56
  173 0.84 8
//
