ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006471
RECORD_TITLE: BORNYL FORMATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, CHEMICAL RESEARCH INSTITUTE OF NON-AQUEOUSSOLUTIONS TOHOKU UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: BORNYL FORMATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₈O₂
CH$EXACT_MASS: 182.13068
CH$SMILES: O=COC(C1)C(C)(C2)C(C)(C)C(C2)1
CH$IUPAC: InChI=1S/C11H18O2/c1-10(2)8-4-5-11(10,3)9(6-8)13-7-12/h7-9H,4-6H2,1-3H3
CH$LINK: INCHIKEY RDWUNORUTVEHJF-UHFFFAOYSA-N

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$SPLASH: splash10-000e-9200000000-d1791aee594f58514eee
PK$NUM_PEAK: 55
PK$PEAK: m/z int. rel.int.
  17 1.07 11
  18 1.31 13
  27 11.42 114
  28 2.66 27
  29 18.09 181
  31 1.15 12
  39 15.8 158
  40 2.62 26
  41 39.27 393
  42 3.2 32
  43 16.96 170
  44 1.24 12
  45 1.01 10
  51 3.3 33
  52 1.49 15
  53 12.17 122
  54 1.78 18
  55 18.27 183
  56 1.62 16
  57 4.25 43
  65 3.84 38
  66 1.49 15
  67 14.5 145
  68 4.68 47
  69 12.04 120
  70 2.64 26
  71 9.47 95
  72 1.43 14
  77 9.01 90
  78 1.59 16
  79 10.37 104
  80 9.62 96
  81 10.36 104
  82 7.03 70
  83 4.9 49
  84 2.59 26
  91 7.55 76
  92 9.76 98
  93 35.66 357
  94 6.31 63
  95 99.99 999
  96 7.67 77
  97 1.27 13
  105 2.68 27
  107 5.01 50
  108 6.48 65
  109 2.46 25
  110 13.01 130
  111 3.01 30
  121 37.34 373
  122 3.68 37
  136 35.13 351
  137 4.62 46
  154 1.37 14
  167 2.49 25
//