ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000979
RECORD_TITLE: N-2,4-DINITROPHENYL-O-TRIMETHYLSILYL-ETHANOLAMINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HORI T, DEPT. OF CHEMISTRY, FAC. OF LIBERAL ARTS AND EDUCATION, SHIGA UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: N-2,4-DINITROPHENYL-O-TRIMETHYLSILYL-ETHANOLAMINE
CH$NAME: N-(2,4-DINITROPHENYL)-2-TRIMETHYLSILYLOXYETHYLAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₇N₃O₅Si
CH$EXACT_MASS: 299.09375
CH$SMILES: [O-1][N+1](=O)c(c1)cc([N+1]([O-1])=O)c(NCCO[Si](C)(C)C)c1
CH$IUPAC: InChI=1S/C11H17N3O5Si/c1-20(2,3)19-7-6-12-10-5-4-9(13(15)16)8-11(10)14(17)18/h4-5,8,12H,6-7H2,1-3H3
CH$LINK: INCHIKEY PPBSFFPMABCFSN-UHFFFAOYSA-N

AC$INSTRUMENT: SHIMADZU LKB-9000
AC$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$SPLASH: splash10-0fmi-9710000000-cb589807fac06503f140
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
  59 5.5 55
  61 4.5 45
  73 99.99 999
  74 9 90
  75 44 440
  103 50 500
  104 9 90
  105 7.5 75
  117 13.5 135
  133 6 60
  150 6 60
  166 9 90
  179 16.5 165
  180 6 60
  196 18 180
  197 3 30
  241 3 30
  269 4.5 45
  284 6 60
  299 12 120
//