MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003521

P-HYDROXYBENZOIC ACID; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003521
RECORD_TITLE: P-HYDROXYBENZOIC ACID; 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

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CH$NAME: P-HYDROXYBENZOIC ACID
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₆O₃
CH$EXACT_MASS: 138.03169
CH$SMILES: Oc(c1)ccc(c1)C(O)=O
CH$IUPAC: InChI=1S/C7H6O3/c8-6-3-1-5(2-4-6)7(9)10/h1-4,8H,(H,9,10)
CH$LINK: INCHIKEY FJKROLUGYXJWQN-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3026647

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AC$INSTRUMENT: HITACHI M-68
AC$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$SPLASH: splash10-00dr-5900000000-9b1d88421f1e1ded16f9
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  38 4.6 46
  39 18.8 188
  45 3.3 33
  50 2.9 29
  51 2.1 21
  53 5.1 51
  55 3.5 35
  61 0.19 2
  62 4.2 42
  63 10.2 102
  65 24 240
  66 0.34 3
  74 1.7 17
  75 1.1 11
  81 3.7 37
  92 0.32 3
  93 20.7 207
  94 1.7 17
  109 1.1 11
  110 0.18 2
  121 99.99 999
  122 7.5 75
  138 70 700
  139 7 70
//