MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003667

1,2,3,4,7,7-HEXAFLUOROBICYCLO(2.2.1)HEPTA-2,5-DIENE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003667
RECORD_TITLE: 1,2,3,4,7,7-HEXAFLUOROBICYCLO(2.2.1)HEPTA-2,5-DIENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

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CH$NAME: 1,2,3,4,7,7-HEXAFLUOROBICYCLO(2.2.1)HEPTA-2,5-DIENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₂F₆
CH$EXACT_MASS: 200.00607
CH$SMILES: [H]C(=C([H])1)C(F)(C(F)=2)C(F)(F)C(F)1C(F)2
CH$IUPAC: InChI=1S/C7H2F6/c8-3-4(9)6(11)2-1-5(3,10)7(6,12)13/h1-2H
CH$LINK: INCHIKEY BFEDHPALJLSLEE-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID00513443

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AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

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MS$FOCUSED_ION: ION_TYPE [M]+*

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//