ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001867
RECORD_TITLE: METHYL 2-TRIMETHYLSILOXYNONADECANOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SEYAMA Y, DEPT. OF PHYSIOL. CHEMISTRY AND NUTRITION, FAC. OF MEDICINE, UNIV. OF TOKYO
LICENSE: CC BY-NC-SA

CH$NAME: METHYL 2-TRIMETHYLSILOXYNONADECANOATE
CH$NAME: METHYL (O-TRIMETHYLSILYL)-ALPHA-HYDROXYNONADECANOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₃H₄₈O₃Si
CH$EXACT_MASS: 400.33727
CH$SMILES: CCCCCCCCCCCCCCCCCC(C(=O)OC)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C23H48O3Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23(24)25-2)26-27(3,4)5/h22H,6-21H2,1-5H3
CH$LINK: INCHIKEY VMAQKURDBISNDM-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:101621147

AC$INSTRUMENT: SHIMADZU LKB-9000B
AC$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$SPLASH: splash10-0006-9207000000-7ae9ddaf279fe36a98e2
PK$NUM_PEAK: 63
PK$PEAK: m/z int. rel.int.
  41 9.4 94
  42 2 20
  43 16.1 161
  45 2 20
  54 1.2 12
  55 9.8 98
  56 2.5 25
  57 14.1 141
  59 5.9 59
  61 1.2 12
  67 4 40
  68 1.8 18
  69 10.3 103
  70 2 20
  71 6.6 66
  72 1.1 11
  73 52.3 523
  74 5.3 53
  75 13.1 131
  76 1.2 12
  77 1.3 13
  81 5 50
  82 2.9 29
  83 10.4 104
  84 1.4 14
  85 3.8 38
  87 1.6 16
  89 24.3 243
  90 2 20
  91 5.4 54
  95 5 50
  97 12 120
  101 2.4 24
  103 14.8 148
  104 1.5 15
  105 2.1 21
  107 1.1 11
  109 2.8 28
  111 5.4 54
  115 2.7 27
  116 1.7 17
  117 1.3 13
  119 2 20
  123 1.1 11
  125 1.7 17
  129 12.9 129
  130 1.6 16
  131 2.2 22
  143 1.6 16
  145 1.6 16
  146 1.8 18
  149 1.1 11
  159 8.1 81
  162 1.4 14
  207 1.8 18
  341 99.99 999
  342 28.3 283
  343 6.8 68
  357 3.6 36
  385 34.6 346
  386 9.2 92
  387 2.1 21
  400 1.1 11
//