MassBank Record: JP002718



 BENZOIC ACID MONO-TMS; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP002718
RECORD_TITLE: BENZOIC ACID MONO-TMS; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HAYASHI A, DEPT. OF CHEMISTRY, FAC. OF SCI. AND TECHNOLOGY, KINKI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: BENZOIC ACID MONO-TMS CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H14O2Si CH$EXACT_MASS: 194.07631 CH$SMILES: O=C(O[Si](C)(C)C)c(c1)cccc1 CH$IUPAC: InChI=1S/C10H14O2Si/c1-13(2,3)12-10(11)9-7-5-4-6-8-9/h4-8H,1-3H3
AC$INSTRUMENT: SHIMADZU LKB-9000B AC$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$SPLASH: splash10-056r-4900000000-6f70fa0b6583ede670ba PK$NUM_PEAK: 88 PK$PEAK: m/z int. rel.int. 40 4.5 45 42 0.9 9 43 5.6 56 44 4.1 41 45 7.1 71 46 0.4 4 47 2.9 29 48 0.01 0 50 3.7 37 51 12.8 128 52 0.8 8 53 0.06 1 54 0.1 1 55 0.5 5 57 0.1 1 58 0.06 1 59 3.6 36 60 0.6 6 62 0.2 2 63 0.02 0 64 0.1 1 65 0.4 4 66 0.1 1 67 0.01 0 70 0.1 1 72 0.8 8 73 6.2 62 74 0.18 2 75 8.3 83 76 3.7 37 77 55.1 551 78 0.41 4 79 0.2 2 85 0.1 1 89 0.1 1 90 0.37 4 91 0.8 8 92 0.2 2 93 0.4 4 95 0.01 0 96 0.1 1 100 0.1 1 101 0.2 2 102 0.02 0 103 0.3 3 104 0.7 7 105 85.6 856 106 0.68 7 107 0.7 7 108 0.1 1 111 0.1 1 115 0.01 0 116 0.2 2 117 0.5 5 119 0.6 6 120 0.02 0 121 0.9 9 122 0.7 7 123 0.1 1 129 0.01 0 132 0.2 2 133 0.2 2 134 0.4 4 135 4.26 43 136 5.9 59 137 1.7 17 138 0.1 1 145 0.01 0 147 0.1 1 148 0.1 1 149 0.3 3 150 0.02 0 151 0.1 1 163 0.2 2 164 0.2 2 165 0.03 0 166 0.1 1 177 0.1 1 178 0.6 6 179 99.99 999 180 15 150 181 4.8 48 182 0.3 3 192 0.01 0 193 1.4 14 194 7.1 71 195 1.1 11 196 0.2 2 //