ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007253
RECORD_TITLE: (3R)-3-(TERT-BUTYLDIMETHYLSILYLOXY)-5-PIVALOYLOXYPENTANOL; 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$NAME: (3R)-3-(TERT-BUTYLDIMETHYLSILYLOXY)-5-PIVALOYLOXYPENTANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₆H₃₄O₄Si
CH$EXACT_MASS: 318.22264
CH$SMILES: OCCC([H])(CCOC(=O)C(C)(C)C)O[Si](C)(C)C(C)(C)C
CH$IUPAC: InChI=1S/C16H34O4Si/c1-15(2,3)14(18)19-12-10-13(9-11-17)20-21(7,8)16(4,5)6/h13,17H,9-12H2,1-8H3/t13-/m1/s1
CH$LINK: INCHIKEY FQTAHDDRQJYHQC-CYBMUJFWSA-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$SPLASH: splash10-0aor-4900000000-97b2d36b8a07d345944a
PK$NUM_PEAK: 36
PK$PEAK: m/z int. rel.int.
  67 59.8 598
  68 4 40
  71 2.3 23
  73 0.82 8
  75 37 370
  76 2.6 26
  85 19.6 196
  89 0.43 4
  101 3.4 34
  105 26.1 261
  106 2.3 23
  115 0.43 4
  117 2.3 23
  129 5.7 57
  131 18.1 181
  132 0.26 3
  141 4.3 43
  144 2.6 26
  145 6.5 65
  147 0.31 3
  157 9.1 91
  159 99.99 999
  160 12.5 125
  161 0.48 5
  169 15.3 153
  170 2.3 23
  171 18.1 181
  172 0.26 3
  177 18.1 181
  187 3.4 34
  189 6.8 68
  231 1.3 13
  232 2 20
  261 8.8 88
  262 1.7 17
  263 0.9 9
//