MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007255
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007255
RECORD_TITLE: (4R)-1-ACETOXY-4-(TERT-BUTYLDIMETHYLSILYLOXY)-5-PIVALOYLOXYHEXENE; 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$NAME: (4R)-1-ACETOXY-4-(TERT-BUTYLDIMETHYLSILYLOXY)-5-PIVALOYLOXYHEXENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C19H36O5Si
CH$EXACT_MASS: 372.23320
CH$SMILES: CC(=O)OC=CCC([H])(C(C)OC(=O)C(C)(C)C)O[Si](C)(C)C(C)(C)C
CH$IUPAC: InChI=1S/C19H36O5Si/c1-14(23-17(21)18(3,4)5)16(12-11-13-22-15(2)20)24-25(9,10)19(6,7)8/h11,13-14,16H,12H2,1-10H3/b13-11-/t14?,16-/m1/s1
CH$LINK: INCHIKEY
XVTNRFPREODEJE-WXMOLBAOSA-N
AC$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: splash10-05fr-3900000000-f6d071fc05c3b8c6ca18
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
43 7.2 72
57 40.7 407
58 2.7 27
73 0.89 9
75 4.1 41
79 3.5 35
86 14.5 145
97 1.11 11
115 14.3 143
117 3.4 34
159 38.9 389
160 0.51 5
161 2.3 23
171 99.99 999
172 15.7 157
173 0.62 6
201 2.2 22
213 11.2 112
214 2 20
273 0.25 3
315 5.3 53
316 1.5 15
317 0.6 6
//