ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007254
RECORD_TITLE: (3S)-3-(TERT-BUTYLDIMETHYLSILYLOXY)-5-TOSYLPENTANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: ITO S, DEPT. OF CHEM., TOHOKU UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: (3S)-3-(TERT-BUTYLDIMETHYLSILYLOXY)-5-TOSYLPENTANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₈H₃₂O₄SSi
CH$EXACT_MASS: 372.17906
CH$SMILES: OCCC([H])(CCS(=O)(=O)c(c1)ccc(C)c1)O[Si](C)(C)C(C)(C)C
CH$IUPAC: InChI=1S/C18H32O4SSi/c1-15-7-9-17(10-8-15)23(20,21)14-12-16(11-13-19)22-24(5,6)18(2,3)4/h7-10,16,19H,11-14H2,1-6H3/t16-/m0/s1
CH$LINK: INCHIKEY SPMRWEUDUQZCPY-INIZCTEOSA-N

AC$INSTRUMENT: HITACHI M-52
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 25 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0002-9320000000-e412481f1b152e11af67
PK$NUM_PEAK: 62
PK$PEAK: m/z int. rel.int.
  41 3.7 37
  43 9 90
  45 99.99 999
  46 0.22 2
  55 5 50
  56 4 40
  57 12.9 129
  58 0.27 3
  59 2.5 25
  60 2 20
  67 13.4 134
  69 0.67 7
  70 5 50
  71 4.5 45
  73 4.7 47
  75 2.16 22
  77 3 30
  81 3.2 32
  83 3.2 32
  85 1.1 11
  87 2.5 25
  88 2.7 27
  89 3 30
  91 0.35 4
  97 5 50
  101 4.7 47
  102 2.7 27
  105 0.42 4
  111 2.2 22
  115 3.5 35
  117 4.7 47
  125 0.22 2
  129 3 30
  131 6.5 65
  132 4 40
  139 0.52 5
  143 2.2 22
  145 4.2 42
  149 8.7 87
  151 0.2 2
  155 2 20
  157 15.7 157
  158 2.2 22
  159 0.47 5
  161 8 80
  171 3.7 37
  189 5.5 55
  205 0.22 2
  213 14.4 144
  214 1.7 17
  215 1.7 17
  223 0.75 8
  231 2.2 22
  281 2.5 25
  285 20.6 206
  286 0.57 6
  287 3.2 32
  297 4 40
  315 6 60
  355 0.2 2
  356 1 10
  357 0.7 7
//