ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011198
RECORD_TITLE: 1,1-DIPHENYLETHANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SAWADA M, THE INST. OF SCIENTIFIC AND INDUSTRIALRESEARCH OSAKA UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 1,1-DIPHENYLETHANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₁₄O
CH$EXACT_MASS: 198.10447
CH$SMILES: c(c2)ccc(c2)C(C)(O)c(c1)cccc1
CH$IUPAC: InChI=1S/C14H14O/c1-14(15,12-8-4-2-5-9-12)13-10-6-3-7-11-13/h2-11,15H,1H3
CH$LINK: INCHIKEY GIMDPFBLSKQRNP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0060519

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$SPLASH: splash10-0560-4900000000-d62fc52ab41948ba5a50
PK$NUM_PEAK: 52
PK$PEAK: m/z int. rel.int.
  39 4.8 48
  43 48.7 487
  44 1.7 17
  50 5.3 53
  51 25.7 257
  52 4.1 41
  53 1.2 12
  63 3.3 33
  65 2.7 27
  74 1.9 19
  75 2.7 27
  76 5.3 53
  77 59.8 598
  78 19.2 192
  79 1.9 19
  83 1.9 19
  89 2.3 23
  91 5.7 57
  92 1.6 16
  99 1 10
  102 2.1 21
  103 5.3 53
  104 1.2 12
  105 76.5 765
  106 10.8 108
  115 2.6 26
  120 1.4 14
  121 26 260
  122 2.6 26
  126 1 10
  127 1.6 16
  128 1.8 18
  139 1.4 14
  151 1.8 18
  152 5.1 51
  153 3.6 36
  154 3.3 33
  155 10.1 101
  156 1.3 13
  165 7.2 72
  166 2.1 21
  176 1 10
  178 3.6 36
  179 2.6 26
  180 1.9 19
  181 4.3 43
  182 2.6 26
  183 99.99 999
  184 30.6 306
  185 2.9 29
  198 42.4 424
  199 7.9 79
//