MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011408
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011408
RECORD_TITLE: 6-METHYL-3-(TRIMETHYLSILYL)METHYL-1-HEPTEN-4-OL; CI-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$NAME: 6-METHYL-3-(TRIMETHYLSILYL)METHYL-1-HEPTEN-4-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H26OSi
CH$EXACT_MASS: 214.17529
CH$SMILES: CC(C)CC(O)C(C=C)C[Si](C)(C)C
CH$IUPAC: InChI=1S/C12H26OSi/c1-7-11(9-14(4,5)6)12(13)8-10(2)3/h7,10-13H,1,8-9H2,2-6H3
CH$LINK: INCHIKEY
XMDRTAVKUHDSRY-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-DX-300
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS METHANE
PK$SPLASH: splash10-00di-9400000000-141c792e7d90ed5990b5
PK$NUM_PEAK: 40
PK$PEAK: m/z int. rel.int.
55 5.9 59
57 6.4 64
67 13.1 131
68 2.1 21
69 36.5 365
70 2.7 27
73 99.99 999
74 12.2 122
75 62.7 627
76 5.6 56
77 3.2 32
81 7.8 78
82 2.5 25
83 12.9 129
87 4.6 46
91 13.3 133
93 5 50
95 4.5 45
97 4.6 46
103 2.5 25
109 7 70
123 16.4 164
124 2.8 28
125 5.9 59
127 3 30
128 5.4 54
129 2.3 23
131 6.2 62
133 2.3 23
141 7.9 79
143 3.2 32
147 3.3 33
149 3.1 31
157 2.3 23
159 8.3 83
163 3.7 37
181 9 90
197 37.8 378
198 8.3 83
199 10.8 108
//
system version 2.2.6-SNAPSHOT