ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002424
RECORD_TITLE: METHYL (3R)-3-(TERT-BUTYLDIMETHYLSILOXY)-6-METHYL-6-HEPTENOATE; 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$NAME: METHYL (3R)-3-(TERT-BUTYLDIMETHYLSILOXY)-6-METHYL-6-HEPTENOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₃₀O₃Si
CH$EXACT_MASS: 286.19642
CH$SMILES: COC(=O)CC([H])(CCC(C)=C)O[Si](C)(C)C(C)(C)C
CH$IUPAC: InChI=1S/C15H30O3Si/c1-12(2)9-10-13(11-14(16)17-6)18-19(7,8)15(3,4)5/h13H,1,9-11H2,2-8H3/t13-/m0/s1
CH$LINK: INCHIKEY YEMXHOTUYCMZCA-ZDUSSCGKSA-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 13.5 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-001i-9320000000-07716dd757bb22448d6f
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  75 13.1 131
  81 99.99 999
  89 5.6 56
  90 0.29 3
  103 28.6 286
  111 3.4 34
  154 7.8 78
  157 1.43 14
  173 8.2 82
  216 1.9 19
  227 2.2 22
  229 6.79 68
  230 13.1 131
  231 8.7 87
  232 3.9 39
  271 2.9 29
//