MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP012198

CYCLOHEXENE; CI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012198
RECORD_TITLE: CYCLOHEXENE; 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$NAME: CYCLOHEXENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₀
CH$EXACT_MASS: 82.07825
CH$SMILES: C(C1)CC=CC1
CH$IUPAC: InChI=1S/C6H10/c1-2-4-6-5-3-1/h1-2H,3-6H2
CH$LINK: CAS 110-83-8
CH$LINK: INCHIKEY HGCIXCUEYOPUTN-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9038717

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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$SPLASH: splash10-001i-9000000000-b2313b76a11e6366c3fa
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
  55 22.75 228
  67 4.48 45
  69 18.04 180
  70 1.11 11
  81 56.12 561
  82 11.34 113
  83 99.99 999
  84 6.53 65
  111 1.35 14
  123 1.84 18
//