ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000246
RECORD_TITLE: BETA-PINENE; 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$NAME: BETA-PINENE
CH$NAME: 2-METHYLENE-6,6-DIMETHYLBICYCLO(3,1,1)HEPTANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₆
CH$EXACT_MASS: 136.12520
CH$SMILES: C=C(C2)C(C1)C(C)(C)C(C2)1
CH$IUPAC: InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h8-9H,1,4-6H2,2-3H3
CH$LINK: INCHIKEY WTARULDDTDQWMU-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7027049

AC$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-0006-9000000000-f8107bfb161eca785a4e
PK$NUM_PEAK: 42
PK$PEAK: m/z int. rel.int.
  26 1 10
  27 22.6 226
  28 2.3 23
  29 0.9 9
  38 1.3 13
  39 29.7 297
  40 4.9 49
  41 6.61 66
  42 3 30
  43 6.7 67
  50 2.3 23
  51 0.74 7
  52 3.7 37
  53 14.5 145
  54 1.7 17
  55 0.81 8
  63 2.2 22
  65 7.4 74
  66 2.3 23
  67 1.26 13
  68 3.5 35
  69 41.2 412
  70 2.3 23
  77 2.33 23
  78 4.2 42
  79 25.3 253
  80 12.2 122
  81 0.32 3
  82 1.5 15
  91 22.6 226
  92 10.3 103
  93 99.99 999
  94 13.8 138
  95 2.7 27
  105 3 30
  106 0.16 2
  107 4.8 48
  108 1.7 17
  121 10.3 103
  122 0.11 1
  136 13.5 135
  137 1.4 14
//