MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007735

2-ACETYLFURAN; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007735
RECORD_TITLE: 2-ACETYLFURAN; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

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CH$NAME: 2-ACETYLFURAN
CH$NAME: 1-(2-FURANYL)ETHANONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₆O₂
CH$EXACT_MASS: 110.03678
CH$SMILES: [H]c(o1)c([H])c([H])c1C(C)=O
CH$IUPAC: InChI=1S/C6H6O2/c1-5(7)6-3-2-4-8-6/h2-4H,1H3
CH$LINK: CAS 1192-62-7
CH$LINK: INCHIKEY IEMMBWWQXVXBEU-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0051601

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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$SPLASH: splash10-01ow-9200000000-39cadbe5f909cbb066e3
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  27 3.18 32
  39 59.04 590
  40 16.98 170
  42 6.15 62
  43 51.02 510
  44 1.71 17
  51 6.34 63
  52 1.02 10
  53 6.34 63
  67 34.06 341
  68 22.32 223
  82 3.18 32
  95 99.99 999
  96 26.22 262
  97 2.01 20
  110 76.12 761
  111 20.23 202
  112 1.06 11
//