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1,4,5,6,7,7-hexachloro-5-norbornene-2,3-dicarboxylic anhydride ferrocene
SpectraBase Compound ID HVDtna7ZfT7
InChI InChI=1S/C15H9Cl6O3.C5H5.Fe/c1-24-12(23)8-7(9(22)6-4-2-3-5-6)13(18)10(16)11(17)14(8,19)15(13,20)21;1-2-4-5-3-1;/h2-5,7-8H,1H3;1-5H;/t7-,8-,13-,14+;;/m0../s1
InChIKey KTZDTVZJURCOSD-VZHLWMEJSA-N
Mol Weight 570.9 g/mol
Molecular Formula C20H14Cl6FeO3
Exact Mass 567.842347 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I8yEIVuZtg3
Name 1,4,5,6,7,7-hexachloro-5-norbornene-2,3-dicarboxylic anhydride ferrocene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14Cl6FeO3
InChI InChI=1S/C15H9Cl6O3.C5H5.Fe/c1-24-12(23)8-7(9(22)6-4-2-3-5-6)13(18)10(16)11(17)14(8,19)15(13,20)21;1-2-4-5-3-1;/h2-5,7-8H,1H3;1-5H;/t7-,8-,13-,14+;;/m0../s1
InChIKey KTZDTVZJURCOSD-VZHLWMEJSA-N
Molecular Weight 570.892 g/mol
SMILES [C@]12([Fe]3456789([C@]2([C@@]5([C@@]4([C@]13[H])[H])[H])[H])[C@@]1([C@]6([C@]7([C@]8([C@]91[H])[H])[H])[H])[H])C([C@]1([C@]2(C(Cl)(Cl)[C@@]([C@@]1(C(=O)OC)[H])(C(Cl)=C2Cl)Cl)Cl)[H])=O
SPLASH splash10-00dj-4370090000-59704a6094813362387f
Source of Spectrum F-51-8018-0
Wiley ID 792819