ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008125
RECORD_TITLE: 2-CYANOMETHYL-3-METHYLAMINO-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$NAME: 2-CYANOMETHYL-3-METHYLAMINO-2-BUTEN-4-OLIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H8N2O2
CH$EXACT_MASS: 152.05858
CH$SMILES: N#CCC(C(=O)1)=C(NC)CO1
CH$IUPAC: InChI=1S/C7H8N2O2/c1-9-6-4-11-7(10)5(6)2-3-8/h9H,2,4H2,1H3
CH$LINK: INCHIKEY OVJFESRPJIBLLE-UHFFFAOYSA-N
AC$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: splash10-0zfr-7900000000-0a81d28288590eb18127
PK$NUM_PEAK: 62
PK$PEAK: m/z int. rel.int.
  38 0.47 5
  39 4.04 40
  40 0.67 7
  41 3.26 33
  42 10.54 105
  43 0.46 5
  44 1.39 14
  50 0.4 4
  51 1.72 17
  52 7.92 79
  53 4.19 42
  54 3.69 37
  55 5.77 58
  56 2.19 22
  58 2.32 23
  64 1.03 10
  65 2.13 21
  66 11.54 115
  67 12.51 125
  68 13.33 133
  69 2.44 24
  72 10.11 101
  73 0.67 7
  76 0.42 4
  77 1.89 19
  78 3.98 40
  79 24.28 243
  80 12.71 127
  81 4.49 45
  82 4.58 46
  83 1.29 13
  84 0.65 7
  91 1.19 12
  92 1.51 15
  93 7.86 79
  94 9.94 99
  95 4.66 47
  96 7.52 75
  97 2.9 29
  98 0.54 5
  105 3.34 33
  106 25.42 254
  107 38.39 384
  108 9.58 96
  109 1.55 16
  112 1.88 19
  119 1.45 15
  121 3.94 39
  122 0.95 10
  123 7.14 71
  124 7.56 76
  125 3.42 34
  126 1.87 19
  133 3.73 37
  134 8.44 84
  135 1.51 15
  136 0.3 3
  137 1.21 12
  151 7.06 71
  152 99.99 999
  153 10.56 106
  154 1.03 10
//
