ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008362
RECORD_TITLE: TRANS-ROSE OXIDE; 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$NAME: TRANS-ROSE OXIDE
CH$NAME: 4-METHYL-TRANS-2-(2-METHYL-1-PROPENYL)PERHYDROPYRAN
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₈O
CH$EXACT_MASS: 154.13577
CH$SMILES: CC(C)=CC([H])(O1)CC([H])(C)CC1
CH$IUPAC: InChI=1S/C10H18O/c1-8(2)6-10-7-9(3)4-5-11-10/h6,9-10H,4-5,7H2,1-3H3/t9-,10+/m1/s1
CH$LINK: INCHIKEY CZCBTSFUTPZVKJ-ZJUUUORDSA-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$SPLASH: splash10-00kr-9300000000-cf7a2855a1450accc836
PK$NUM_PEAK: 40
PK$PEAK: m/z int. rel.int.
  15 1.06 11
  27 13.65 137
  29 15.17 152
  31 1.23 12
  32 1.05 11
  39 18.85 189
  40 2.42 24
  41 34.6 346
  42 13.98 140
  43 7.27 73
  51 2.07 21
  53 7 70
  54 2.27 23
  55 29.17 292
  56 8.31 83
  57 1.79 18
  65 1.92 19
  66 1.38 14
  67 11.82 118
  68 1.89 19
  69 60.4 604
  70 3.26 33
  71 1.01 10
  77 2.35 24
  79 2.35 24
  81 2.9 29
  82 4.6 46
  83 27.67 277
  84 13.24 132
  85 12.39 124
  93 1.12 11
  97 3.06 31
  99 1.18 12
  109 1.38 14
  112 2.13 21
  139 99.99 999
  140 9.23 92
  153 1.44 14
  154 10.19 102
  155 1.04 10
//