MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010003

1-ETHOXY-3-METHYL-2-BUTENE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010003
RECORD_TITLE: 1-ETHOXY-3-METHYL-2-BUTENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA

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CH$NAME: 1-ETHOXY-3-METHYL-2-BUTENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₁₄O
CH$EXACT_MASS: 114.10447
CH$SMILES: CCOCC=C(C)C
CH$IUPAC: InChI=1S/C7H14O/c1-4-8-6-5-7(2)3/h5H,4,6H2,1-3H3
CH$LINK: INCHIKEY HPMSQLYFMOOLKS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID20176599

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AC$INSTRUMENT: JEOL JMS-D-300
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-00xv-9000000000-3d89bf8995a2b7bebe2f
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  27 17.9 179
  29 32 320
  31 6.8 68
  39 1.62 16
  40 4.4 44
  41 67.5 675
  42 6.4 64
  43 1.78 18
  44 3.7 37
  45 3 30
  53 14.2 142
  54 0.19 2
  55 10.4 104
  57 8.7 87
  59 3.4 34
  67 1.62 16
  68 19.9 199
  69 44.5 445
  70 5.5 55
  71 99.99 999
  72 5.2 52
  85 9.9 99
  99 81.9 819
  100 0.56 6
  114 23.1 231
  115 1.7 17
//