ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011655
RECORD_TITLE: PERFLUOROTRIBUTYLAMINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: PERFLUOROTRIBUTYLAMINE
CH$NAME: HEPTACOSAFLUOROTRIBUTYLAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂F₂₇N
CH$EXACT_MASS: 670.95996
CH$SMILES: FC(F)(F)C(F)(F)C(F)(F)C(F)(F)N(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F
CH$IUPAC: InChI=1S/C12F27N/c13-1(14,7(25,26)27)4(19,20)10(34,35)40(11(36,37)5(21,22)2(15,16)8(28,29)30)12(38,39)6(23,24)3(17,18)9(31,32)33
CH$LINK: CAS 311-89-7
CH$LINK: NIKKAJI J11.843E
CH$LINK: INCHIKEY RVZRBWKZFJCCIB-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0027141

AC$INSTRUMENT: HITACHI M-2500
AC$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$SPLASH: splash10-014i-5490110000-9a01b29094d0274f88df
PK$NUM_PEAK: 31
PK$PEAK: m/z int. rel.int.
  51 1.24 12
  69 77.06 771
  100 10.29 103
  113 2.25 23
  114 3.61 36
  119 8.47 85
  131 40.53 405
  132 1.32 13
  150 2.76 28
  164 1.1 11
  169 2.99 30
  181 2.08 21
  201 2.39 24
  214 1.35 14
  219 99.99 999
  220 4.45 45
  228 1.04 10
  246 2.23 22
  264 23.73 237
  265 1.28 13
  376 1.12 11
  396 2.5 25
  414 11.61 116
  415 1.03 10
  448 2.36 24
  464 3.91 39
  466 3.52 35
  484 3.95 40
  502 23.54 235
  503 2.44 24
  614 2.5 25
//