ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008399
RECORD_TITLE: BETA-MYRCENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: BETA-MYRCENE
CH$NAME: 7-METHYL-3-METHYLENE-1,6-OCTADIENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₆
CH$EXACT_MASS: 136.12520
CH$SMILES: C=CC(=C)CCC=C(C)C
CH$IUPAC: InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7H,1,4,6,8H2,2-3H3
CH$LINK: INCHIKEY UAHWPYUMFXYFJY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6025692

AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-0006-9000000000-078927c5db5ba8691e12
PK$NUM_PEAK: 36
PK$PEAK: m/z int. rel.int.
  27 18.94 189
  28 1.06 11
  29 5.39 54
  38 1.24 12
  39 25.87 259
  40 4.9 49
  41 97.95 980
  42 3.91 39
  43 3.11 31
  50 1.91 19
  51 6.41 64
  52 3.26 33
  53 15.22 152
  54 1.62 16
  55 3.3 33
  63 1.54 15
  65 5.88 59
  66 2.26 23
  67 10.64 106
  68 4.57 46
  69 84.59 846
  70 4.02 40
  77 12.34 123
  78 2.01 20
  79 13.86 139
  80 7.44 74
  81 1.63 16
  82 1.36 14
  91 12.49 125
  92 9.11 91
  93 99.99 999
  94 10.25 103
  105 1.52 15
  107 2.22 22
  121 4.06 41
  136 4.23 42
//