MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP012335

ACENAPHTHYLENE; CI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012335
RECORD_TITLE: ACENAPHTHYLENE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: IIDA Y, DAISHIMA S, FAC. OF ENGINEERING, SEIKEI UNIV.
LICENSE: CC BY-NC-SA

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CH$NAME: ACENAPHTHYLENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₈
CH$EXACT_MASS: 152.06260
CH$SMILES: c(c3)cc(C=1)c(c32)c(ccc2)C1
CH$IUPAC: InChI=1S/C12H8/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-8H
CH$LINK: CAS 208-96-8
CH$LINK: INCHIKEY HXGDTGSAIMULJN-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3023845

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AC$INSTRUMENT: FINNIGAN-MAT 4500
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 120 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS METHANE

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PK$SPLASH: splash10-0udi-0900000000-bb91d22811d4a68446e9
PK$NUM_PEAK: 8
PK$PEAK: m/z int. rel.int.
  152 8.38 84
  153 99.99 999
  154 13.68 137
  155 1.59 16
  181 24.47 245
  182 3.78 38
  193 6.09 61
  194 1.03 10
//