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Manganese(ii) bis(3-heptafluorobutyrylcamphorate)
SpectraBase Compound ID 9mkpwD79Wye
InChI InChI=1S/2C14H15F7O2.Mn/c2*1-10(2)6-4-5-11(10,3)8(22)7(6)9(23)12(15,16)13(17,18)14(19,20)21;/h2*6,23H,4-5H2,1-3H3;/b9-7+;9-7-;/t2*6-,11+;/m11./s1
InChIKey AEGFRPZVFKRWJS-UYEITISKSA-N
Mol Weight 751.46 g/mol
Molecular Formula C28H30F14MnO4
Exact Mass 751.130097 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 13NwTfZzVix
Name Manganese(ii) bis(3-heptafluorobutyrylcamphorate)
Alternate Name(s) (3E)-3-(2,2,3,3,4,4,4-heptafluoro-1-hydroxybutylidene)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one (3Z)-3-(2,2,3,3,4,4,4-heptafluoro-1-hydroxybutylidene)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one manganese
CAS Registry Number 76059-35-3
Comments Note: The molecular formula of the structure shown is C28H30F14MnO4 - which differs from the formula reported for the mass spectrum (C28H28F14MnO4)
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Formula C28H28F14MnO4
InChI InChI=1S/2C14H15F7O2.Mn/c2*1-10(2)6-4-5-11(10,3)8(22)7(6)9(23)12(15,16)13(17,18)14(19,20)21;/h2*6,23H,4-5H2,1-3H3;/b9-7+;9-7-;/t2*6-,11+;/m11./s1
InChIKey AEGFRPZVFKRWJS-UYEITISKSA-N
Molecular Weight 751.460 g/mol
SMILES O\C(=C/1C([C@@]2(CC[C@]1(C2(C)C)[H])C)=O)C(F)(F)C(F)(F)C(F)(F)F.[Mn].O\C(=C\1C([C@@]2(CC[C@]1(C2(C)C)[H])C)=O)C(F)(F)C(F)(F)C(F)(F)F
SPLASH splash10-0fdk-3729000300-eac6ffa44cc451ed62bd
Source of Spectrum W5-1989-33421-32115
Wiley ID 1416301