MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007259
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007259
RECORD_TITLE: (3S,4R,5S)-4-(TERT-BUTYLDIMETHYLSILYLOXY)-1,1-DIBROMO-3,5-DIMETHYL-1-HEPTENE; 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$NAME: (3S,4R,5S)-4-(TERT-BUTYLDIMETHYLSILYLOXY)-1,1-DIBROMO-3,5-DIMETHYL-1-HEPTENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H30Br2OSi
CH$EXACT_MASS: 412.04327
CH$SMILES: CCC([H])(C)C([H])(O[Si](C)(C)C(C)(C)C)C([H])(C)C=C(Br)Br
CH$IUPAC: InChI=1S/C15H30Br2OSi/c1-9-11(2)14(12(3)10-13(16)17)18-19(7,8)15(4,5)6/h10-12,14H,9H2,1-8H3/t11-,12-,14+/m0/s1
CH$LINK: INCHIKEY
RVMWJIWHPXCBGC-SGMGOOAPSA-N
AC$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 25 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0udi-2190000000-3b397b8a20d9350291fa
PK$NUM_PEAK: 43
PK$PEAK: m/z int. rel.int.
41 2.7 27
43 3.9 39
53 8 80
55 0.18 2
57 3.7 37
58 1.8 18
69 6.6 66
73 5.04 50
74 4.1 41
75 11.1 111
83 2.1 21
87 0.29 3
89 3.1 31
109 2.5 25
115 16.8 168
116 0.18 2
137 3.7 37
139 3.9 39
143 1.8 18
145 1.52 15
146 2.1 21
161 2.1 21
163 1.8 18
189 1.05 11
191 7.8 78
201 99.99 999
202 17.6 176
203 1.01 10
205 5.8 58
223 8 80
225 8 80
269 2.8 28
270 3.5 35
271 56.8 568
272 6.2 62
273 2.88 29
274 3.9 39
355 7.4 74
356 1.2 12
357 1.4 14
358 2.5 25
359 7.6 76
360 1.4 14
//