ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006477
RECORD_TITLE: ALPHA-TERPINYL 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$NAME: ALPHA-TERPINYL FORMATE
CH$NAME: P-MENTH-1-EN-8-YL FORMATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₈O₂
CH$EXACT_MASS: 182.13068
CH$SMILES: O=COC(C)(C)C(C1)CC=C(C)C1
CH$IUPAC: InChI=1S/C11H18O2/c1-9-4-6-10(7-5-9)11(2,3)13-8-12/h4,8,10H,5-7H2,1-3H3
CH$LINK: INCHIKEY IPYLQIQMGUZFCK-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID20862849

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$SPLASH: splash10-006x-9400000000-f0824f09ac00bfb006c8
PK$NUM_PEAK: 45
PK$PEAK: m/z int. rel.int.
  18 2.01 20
  27 6.11 61
  28 1.52 15
  29 7.33 73
  31 3.97 40
  39 13.29 133
  40 2.64 26
  41 25.44 254
  42 1.83 18
  43 19.11 191
  51 2.66 27
  52 1.46 15
  53 12.11 121
  54 1.96 20
  55 10.38 104
  59 26 260
  65 3.49 35
  66 1.57 16
  67 18.08 181
  68 12.63 126
  69 11.11 111
  71 2.79 28
  77 12.35 124
  78 2.09 21
  79 15.9 159
  80 6.1 61
  81 24.09 241
  82 1.81 18
  91 10.81 108
  92 11.81 118
  93 71.74 717
  94 8.95 90
  95 15.64 156
  96 1.43 14
  105 4.11 41
  106 1.15 12
  107 10.67 107
  108 4.76 48
  119 1.16 12
  121 99.99 999
  122 9.56 96
  136 55.47 555
  137 14.14 141
  138 1.15 12
  139 2.07 21
//