MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007596

TETRADECAN-2-OL; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007596
RECORD_TITLE: TETRADECAN-2-OL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAKEUCHI T, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

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CH$NAME: TETRADECAN-2-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₃₀O
CH$EXACT_MASS: 214.22967
CH$SMILES: CCCCCCCCCCCCC(C)O
CH$IUPAC: InChI=1S/C14H30O/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h14-15H,3-13H2,1-2H3
CH$LINK: CAS 4706-81-4
CH$LINK: INCHIKEY BRGJIIMZXMWMCC-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID00871095

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AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0002-9000000000-d2fed48b4a0a9ad43ba0
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  31 2.31 23
  43 30.47 305
  45 99.99 999
  55 21.85 219
  57 20.36 204
  69 13.09 131
  71 8.73 87
  83 10.03 100
  84 5.32 53
  97 8.11 81
  98 3.36 34
  111 4.24 42
  112 2.27 23
  125 1.97 20
  126 1.36 14
  168 1.59 16
  196 1.39 14
  199 1.06 11
//