MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007461
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007461
RECORD_TITLE: 4-PROPOXYBENZOIC 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$NAME: 4-PROPOXYBENZOIC ACID TRIMETHYLSILYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H20O3Si
CH$EXACT_MASS: 252.11817
CH$SMILES: CCCOc(c1)ccc(c1)C(=O)O[Si](C)(C)C
CH$IUPAC: InChI=1S/C13H20O3Si/c1-5-10-15-12-8-6-11(7-9-12)13(14)16-17(2,3)4/h6-9H,5,10H2,1-4H3
CH$LINK: INCHIKEY
KDBNKAABHTUJBG-UHFFFAOYSA-N
AC$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: splash10-000j-4980000000-ce5dcb9aafb4267d61f1
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
43 8.3 83
45 3.3 33
47 2.5 25
50 0.13 1
63 2.5 25
64 7.1 71
65 12.2 122
73 0.81 8
75 14.5 145
76 4.4 44
77 2.7 27
89 0.13 1
92 8.1 81
93 14.5 145
103 1.3 13
104 0.22 2
120 1.6 16
121 45.5 455
122 6.7 67
151 2.06 21
163 23.4 234
164 2.5 25
166 1.6 16
193 4.24 42
194 9.4 94
195 71.7 717
196 10 100
197 0.3 3
237 99.99 999
238 18.4 184
239 6.1 61
251 0.16 2
252 35.7 357
253 5.5 55
254 1.6 16
//