ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003360
RECORD_TITLE: DIBUTYL TIN MALEATE; 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$NAME: DIBUTYL TIN MALEATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₂₀O₄Sn
CH$EXACT_MASS: 348.03836
CH$SMILES: CCCC[Sn](CCCC)(O1)OC(=O)C=CC(=O)1
CH$IUPAC: InChI=1S/C4H4O4.2C4H9.Sn/c5-3(6)1-2-4(7)8;2*1-3-4-2;/h1-2H,(H,5,6)(H,7,8);2*1,3-4H2,2H3;/q;;;+2/p-2/b2-1-;;;
CH$LINK: INCHIKEY ZBBLRPRYYSJUCZ-GRHBHMESSA-L
CH$LINK: COMPTOX DTXSID6029599

AC$INSTRUMENT: JEOL JMS-01-SG-2
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0udi-9010000000-37fbc0a3f43b181c868c
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  44 17.8 178
  52 4.1 41
  53 16 160
  54 99.99 999
  55 8.2 82
  56 25.7 257
  98 34 340
  99 0.2 2
  105 2.6 26
  121 2.2 22
  153 2 20
  155 0.32 3
  175 3.6 36
  177 4.1 41
  211 2 20
  213 0.2 2
  265 2.9 29
  266 1.8 18
  267 5.8 58
  268 0.33 3
  269 8.4 84
  270 1.1 11
  271 3.3 33
  273 0.16 2
  289 0.9 9
  291 1.3 13
//