MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007478
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007478
RECORD_TITLE: 4-METHYL-2-PENTENOIC ACID TRIMETHYLSILYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA
CH$NAME: 4-METHYL-2-PENTENOIC ACID TRIMETHYLSILYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H18O2Si
CH$EXACT_MASS: 186.10761
CH$SMILES: CC(C)C=CC(=O)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C9H18O2Si/c1-8(2)6-7-9(10)11-12(3,4)5/h6-8H,1-5H3/b7-6+
CH$LINK: INCHIKEY
WDZGZGHIOXHTBN-VOTSOKGWSA-N
AC$INSTRUMENT: JEOL JMS-01-SG
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: splash10-00fr-9400000000-3e5b62441a563c7c9156
PK$NUM_PEAK: 51
PK$PEAK: m/z int. rel.int.
40 0.9 9
41 0.9 9
43 3.7 37
44 0.42 4
45 10.4 104
47 7.1 71
51 2.3 23
53 0.52 5
54 2.8 28
55 3.7 37
59 3.7 37
61 0.42 4
67 3.3 33
68 3.3 33
69 3.7 37
72 0.09 1
73 61.1 611
74 7.5 75
75 99.99 999
76 0.66 7
77 3.3 33
79 1.4 14
81 10.9 109
82 0.18 2
85 4.7 47
95 2.3 23
96 34.1 341
97 1.89 19
98 0.9 9
99 8 80
101 0.9 9
111 0.28 3
116 1.8 18
117 0.9 9
125 3.7 37
126 0.52 5
127 12.7 127
128 1.4 14
129 3.7 37
131 0.33 3
141 1.8 18
143 8.5 85
144 0.9 9
153 0.14 1
155 2.3 23
170 9 90
171 73.9 739
172 0.99 10
173 2.8 28
186 14.2 142
187 0.9 9
//