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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003969

2-BUTOXY-4-QUINOLINECARBOXYLIC ACID TRIMETHYLSILYL ESTER; CI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003969
RECORD_TITLE: 2-BUTOXY-4-QUINOLINECARBOXYLIC ACID TRIMETHYLSILYL ESTER; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: 2-BUTOXY-4-QUINOLINECARBOXYLIC ACID TRIMETHYLSILYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C17H23NO3Si
CH$EXACT_MASS: 317.14472
CH$SMILES: CCCCOc(n1)cc(C(=O)O[Si](C)(C)C)c(c2)c(ccc2)1
CH$IUPAC: InChI=1S/C17H23NO3Si/c1-5-6-11-20-16-12-14(17(19)21-22(2,3)4)13-9-7-8-10-15(13)18-16/h7-10,12H,5-6,11H2,1-4H3
CH$LINK: INCHIKEY GUBMDNNJMZCTQQ-UHFFFAOYSA-N

AC$INSTRUMENT: HITACHI M-60
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 100 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE

PK$SPLASH: splash10-014i-1139000000-0df4c3070e833c866739
PK$NUM_PEAK: 80
PK$PEAK: m/z int. rel.int.
  82 18.09 181
  83 6.01 60
  86 0.23 2
  88 0.67 7
  90 2.8 28
  92 1.16 12
  93 0.35 4
  95 0.9 9
  96 0.32 3
  98 0.51 5
  99 0.14 1
  102 0.28 3
  104 0.19 2
  106 0.84 8
  107 0.33 3
  109 0.14 1
  115 0.34 3
  116 0.69 7
  117 0.57 6
  120 0.16 2
  123 0.21 2
  125 0.11 1
  127 0.16 2
  128 0.54 5
  129 0.16 2
  130 0.17 2
  131 0.3 3
  132 0.33 3
  133 2.89 29
  134 0.26 3
  136 0.19 2
  137 0.13 1
  143 0.66 7
  144 0.64 6
  145 0.41 4
  146 0.3 3
  147 0.13 1
  162 0.11 1
  164 4.27 43
  165 0.82 8
  173 0.62 6
  186 0.35 4
  199 0.23 2
  200 0.31 3
  202 1.38 14
  203 0.35 4
  216 2.6 26
  217 0.67 7
  218 0.48 5
  219 0.24 2
  228 6.64 66
  229 1.2 12
  230 0.46 5
  244 0.2 2
  245 0.57 6
  246 5.51 55
  247 0.99 10
  248 0.16 2
  256 0.22 2
  258 0.22 2
  261 14.9 149
  262 5.69 57
  263 1.61 16
  264 1.13 11
  268 2.6 26
  269 0.34 3
  270 1.41 14
  272 1.23 12
  289 1.35 14
  290 0.45 5
  302 5.79 58
  303 1.27 13
  305 0.55 6
  316 2.22 22
  317 8.07 81
  318 99.99 999
  319 24.47 245
  320 8.82 88
  321 1.62 16
  322 0.2 2
//

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