MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008995

PHENYL SALICYLATE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008995
RECORD_TITLE: PHENYL SALICYLATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

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CH$NAME: PHENYL SALICYLATE
CH$NAME: SALOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₁₀O₃
CH$EXACT_MASS: 214.06299
CH$SMILES: Oc(c2)c(ccc2)C(=O)Oc(c1)cccc1
CH$IUPAC: InChI=1S/C13H10O3/c14-12-9-5-4-8-11(12)13(15)16-10-6-2-1-3-7-10/h1-9,14H
CH$LINK: CAS 118-55-8
CH$LINK: INCHIKEY ZQBAKBUEJOMQEX-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6021957

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AC$INSTRUMENT: HITACHI M-80B
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-00di-4900000000-fcc0d5e766dfb52cf2d9
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
  40 1.75 18
  50 1.58 16
  51 2.47 25
  53 2.32 23
  62 1.28 13
  63 4.45 45
  64 3.45 35
  65 18.1 181
  66 2.54 25
  92 4.53 45
  93 7.9 79
  94 2.94 29
  120 2.44 24
  121 99.99 999
  122 6.69 67
  214 7.68 77
  215 1.28 13
//