ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011405
RECORD_TITLE: 3-ETHENYL-2,5-BIS(2-METHYLPROPYL)TETRAHYDROFURAN; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, INSTITUTE FOR CHEMICAL REACTION SCIENCE TOHOKU UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 3-ETHENYL-2,5-BIS(2-METHYLPROPYL)TETRAHYDROFURAN
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₂₆O
CH$EXACT_MASS: 210.19837
CH$SMILES: CC(C)CC(C1)OC(CC(C)C)C(C=C)1
CH$IUPAC: InChI=1S/C14H26O/c1-6-12-9-13(7-10(2)3)15-14(12)8-11(4)5/h6,10-14H,1,7-9H2,2-5H3
CH$LINK: INCHIKEY ITEQWNDUNHFRAG-UHFFFAOYSA-N

AC$INSTRUMENT: JEOL JMS-DX-300
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS METHANE

PK$SPLASH: splash10-0mn9-5920000000-7e513527f125db63bea6
PK$NUM_PEAK: 43
PK$PEAK: m/z int. rel.int.
  54 2.1 21
  55 4.6 46
  57 23.7 237
  66 2.7 27
  67 7.2 72
  68 3.7 37
  69 68 680
  70 4.9 49
  71 4.2 42
  80 2.9 29
  81 24.8 248
  82 12.2 122
  83 27.7 277
  85 22.7 227
  87 17.5 175
  95 24.7 247
  96 9.1 91
  97 17.6 176
  109 51.2 512
  110 5.3 53
  111 12.1 121
  113 2 20
  115 5.7 57
  123 26 260
  124 18.2 182
  125 99.99 999
  126 11.4 114
  127 3.5 35
  135 4.9 49
  137 48.6 486
  138 6.2 62
  151 2.9 29
  153 58.8 588
  154 7.5 75
  155 6.5 65
  191 2.7 27
  193 40.1 401
  194 6.6 66
  197 3.7 37
  209 23.3 233
  210 4.3 43
  211 84 840
  212 14.8 148
//