MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP012098
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012098
RECORD_TITLE: 6-METHYL-5-TRIMETHYLSILYLMETHYL-6-HEPTEN-2-ONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, INSTITUTE FOR CHEMICAL REACTION SCIENCE TOHOKU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 6-METHYL-5-TRIMETHYLSILYLMETHYL-6-HEPTEN-2-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H24OSi
CH$EXACT_MASS: 212.15964
CH$SMILES: CC(=O)CCC(C(C)=C)C[Si](C)(C)C
CH$IUPAC: InChI=1S/C12H24OSi/c1-10(2)12(8-7-11(3)13)9-14(4,5)6/h12H,1,7-9H2,2-6H3
CH$LINK: INCHIKEY
AJNMYAQSXRODBL-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-DX-300
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: splash10-00di-9500000000-2afa9eabf6f50ef8f1bb
PK$NUM_PEAK: 41
PK$PEAK: m/z int. rel.int.
39 2.2 22
41 3.3 33
43 16.1 161
44 2.9 29
45 10.3 103
53 2.2 22
55 2.1 21
58 2.6 26
59 8.4 84
67 2.4 24
72 2.6 26
73 99.99 999
74 10.8 108
75 41.6 416
76 3.3 33
77 2.7 27
85 3.1 31
93 2.2 22
99 2.8 28
107 15.1 151
111 3.4 34
112 2.6 26
115 11.7 117
121 3 30
122 17.7 177
123 2.7 27
127 2.6 26
129 5.4 54
130 9.3 93
139 2.5 25
141 14.5 145
142 2.5 25
143 4.4 44
144 4.3 43
154 9.8 98
155 2.2 22
169 3.6 36
183 1.8 18
194 1.6 16
197 5.1 51
212 0.6 6
//
system version 2.2.6-SNAPSHOT