ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011451
RECORD_TITLE: 3,3',5,5'-TETRA-METHYL-4,4'-DICYCLOPROPYL-METHYLOXY-BIPHENYL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: FUJISE Y, HAMAMATSU UNIV. SCHOOL OF MEDICINE
LICENSE: CC BY-NC-SA

CH$NAME: 3,3',5,5'-TETRA-METHYL-4,4'-DICYCLOPROPYL-METHYLOXY-BIPHENYL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₄H₃₀O₂
CH$EXACT_MASS: 350.22458
CH$SMILES: Cc(c1)c(OCC(C4)C4)c(C)cc1c(c2)cc(C)c(OCC(C3)C3)c(C)2
CH$IUPAC: InChI=1S/C24H30O2/c1-15-9-21(10-16(2)23(15)25-13-19-5-6-19)22-11-17(3)24(18(4)12-22)26-14-20-7-8-20/h9-12,19-20H,5-8,13-14H2,1-4H3
CH$LINK: INCHIKEY ROUMLMHVPQDDRQ-UHFFFAOYSA-N

AC$INSTRUMENT: JEOL JMS-DX-300
AC$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$SPLASH: splash10-0f6y-2192000000-77a8078906d8f0fc462a
PK$NUM_PEAK: 91
PK$PEAK: m/z int. rel.int.
  36 12.4 124
  40 7.67 77
  41 4.94 49
  42 1.02 10
  43 6.99 70
  44 3.66 37
  51 1.43 14
  53 0.73 7
  54 2.33 23
  55 75.39 754
  56 0.64 6
  57 2.65 27
  65 1.05 11
  69 2.93 29
  71 2.67 27
  77 2.3 23
  81 1.4 14
  89 1.05 11
  90 1.43 14
  91 3.26 33
  105 1.46 15
  115 1.86 19
  121 1.01 10
  128 2.73 27
  129 2.1 21
  135 1.08 11
  141 2.28 23
  142 1.04 10
  143 1.08 11
  149 1.87 19
  152 2.1 21
  153 2.95 30
  154 2.26 23
  155 1.7 17
  157 1.33 13
  159 1.06 11
  165 4.81 48
  166 2.52 25
  167 2.69 27
  168 1.43 14
  169 3.45 35
  170 1.42 14
  171 1.51 15
  172 1.51 15
  178 1.31 13
  179 2.34 23
  180 2.19 22
  181 3.91 39
  182 2.94 29
  183 4.15 42
  184 1.73 17
  185 3.17 32
  195 2.64 26
  196 1.86 19
  197 5.25 53
  198 10.42 104
  199 2.88 29
  200 5.95 60
  209 1.77 18
  210 1.4 14
  211 3.59 36
  212 2.86 29
  213 6.24 62
  214 2.55 26
  215 1.43 14
  223 1.07 11
  224 1.42 14
  225 3.38 34
  226 3.58 36
  227 1.63 16
  239 2.1 21
  240 7 70
  241 98.1 981
  242 78.08 781
  243 15.62 156
  255 5.14 51
  256 1.69 17
  267 2.52 25
  268 4.81 48
  269 1.79 18
  270 6.47 65
  271 1.73 17
  279 1.11 11
  295 24.46 245
  296 99.99 999
  297 28.55 286
  322 1.95 20
  326 1.83 18
  328 1.82 18
  350 92.12 921
  351 34.07 341
//