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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003063

DECAFLUOROBENZOPHENONE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003063
RECORD_TITLE: DECAFLUOROBENZOPHENONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: DECAFLUOROBENZOPHENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13F10O
CH$EXACT_MASS: 361.97895
CH$SMILES: Fc(c(F)2)c(F)c(F)c(c(F)2)C(=O)c(c(F)1)c(F)c(F)c(F)c(F)1
CH$IUPAC: InChI=1S/C13F10O/c14-3-1(4(15)8(19)11(22)7(3)18)13(24)2-5(16)9(20)12(23)10(21)6(2)17
CH$LINK: INCHIKEY WWQLXRAKBJVNCC-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID60234501

AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-014j-1900000000-6400a01250adaf421806
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  31 7.3 73
  55 0.9 9
  69 1.1 11
  74 0.21 2
  79 6.2 62
  86 2.1 21
  93 15.8 158
  98 0.73 7
  110 1.4 14
  117 57.8 578
  118 3 30
  129 0.16 2
  141 1.3 13
  165 1.2 12
  167 62.5 625
  168 0.38 4
  176 1.1 11
  181 1.5 15
  195 99.99 999
  196 0.12 1
  197 1 10
  227 1 10
  265 1.3 13
  362 0.34 3
  363 4.4 44
//

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