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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004982

1,1-DICHLORO-4-PHENYL-1-TRIMETHYLSILYL-2-BUTANOL; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004982
RECORD_TITLE: 1,1-DICHLORO-4-PHENYL-1-TRIMETHYLSILYL-2-BUTANOL; EI-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$NAME: 1,1-DICHLORO-4-PHENYL-1-TRIMETHYLSILYL-2-BUTANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H20Cl2OSi
CH$EXACT_MASS: 290.06605
CH$SMILES: c(c1)ccc(c1)CCC(O)C(Cl)(Cl)[Si](C)(C)C
CH$IUPAC: InChI=1S/C13H20Cl2OSi/c1-17(2,3)13(14,15)12(16)10-9-11-7-5-4-6-8-11/h4-8,12,16H,9-10H2,1-3H3
CH$LINK: INCHIKEY CNMYGWLCQSBOOX-UHFFFAOYSA-N

AC$INSTRUMENT: JEOL JMS-D-3000
AC$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$SPLASH: splash10-004l-8930000000-9ff99bb7635893c5bb1e
PK$NUM_PEAK: 31
PK$PEAK: m/z int. rel.int.
  45 12.24 122
  59 3.14 31
  72 3.9 39
  73 91.32 913
  74 5.46 55
  75 12.42 124
  91 99.99 999
  93 31.14 311
  95 3.72 37
  103 3.9 39
  104 37.89 379
  117 35.62 356
  123 8.33 83
  125 72.87 729
  126 4.23 42
  127 21.5 215
  129 90.17 902
  130 6.85 69
  165 11.46 115
  185 2.75 28
  200 28.06 281
  201 4.28 43
  202 17.9 179
  203 3.9 39
  204 3.45 35
  207 20.67 207
  208 4.55 46
  239 13.7 137
  241 4.76 48
  254 1.37 14
  290 0.45 5
//

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