ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007256
RECORD_TITLE: (3S)-5-BROMO-3-(TERT-BUTYLDIMETHYLSILYLOXY)-1-PIVALOYLOXYPENTANE; 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$NAME: (3S)-5-BROMO-3-(TERT-BUTYLDIMETHYLSILYLOXY)-1-PIVALOYLOXYPENTANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₆H₃₃BrO₃Si
CH$EXACT_MASS: 380.13823
CH$SMILES: BrCCC([H])(CCOC(=O)C(C)(C)C)O[Si](C)(C)C(C)(C)C
CH$IUPAC: InChI=1S/C16H33BrO3Si/c1-15(2,3)14(18)19-12-10-13(9-11-17)20-21(7,8)16(4,5)6/h13H,9-12H2,1-8H3/t13-/m1/s1
CH$LINK: INCHIKEY HEFXUJHDVOFZKD-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 14 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0a4r-9300000000-4f9b1044e7b46227c158
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  41 2 20
  55 5.4 54
  56 99.99 999
  57 0.48 5
  67 4.6 46
  75 1.8 18
  85 94.7 947
  86 0.48 5
  103 4 40
  147 3.4 34
  159 67.9 679
  160 0.2 2
  161 2.4 24
  171 4.2 42
  177 7.9 79
  249 0.18 2
  251 5.8 58
  323 7.3 73
  324 2.2 22
  325 1.07 11
  326 0.8 8
//