MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007276
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007276
RECORD_TITLE: METHYL 3-OXO-5-TRIMETHYLSILYLETHOXYPENTANOATE; 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$NAME: METHYL 3-OXO-5-TRIMETHYLSILYLETHOXYPENTANOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H22O4Si
CH$EXACT_MASS: 246.12874
CH$SMILES: COC(=O)CC(=O)CCOCC[Si](C)(C)C
CH$IUPAC: InChI=1S/C11H22O4Si/c1-14-11(13)9-10(12)5-6-15-7-8-16(2,3)4/h5-9H2,1-4H3
CH$LINK: INCHIKEY
CGODJIKNHUDKMC-UHFFFAOYSA-N
AC$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: splash10-0fl0-1920000000-62d82c4bc7947aa4f807
PK$NUM_PEAK: 42
PK$PEAK: m/z int. rel.int.
55 2.2 22
58 1.8 18
73 36 360
74 0.26 3
75 7 70
85 3.7 37
97 28 280
98 1.06 11
99 1.8 18
100 3.3 33
101 8.4 84
103 1.39 14
107 4 40
116 1.8 18
117 48 480
118 0.22 2
127 16.8 168
128 6.6 66
130 78 780
131 1.25 13
142 2.2 22
143 50 500
144 3.7 37
145 2.56 26
146 21.6 216
158 25.3 253
159 1.8 18
161 2.6 26
171 20.5 205
172 3.3 33
173 99.99 999
174 1.21 12
185 3.7 37
186 5.5 55
187 28 280
188 0.44 4
199 1.8 18
202 4.4 44
203 90 900
204 1.72 17
205 4 40
217 2.2 22
//
system version 2.2.8-SNAPSHOT