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(1r,4r,6R,7S,8R,9S)-6,7,8,9-tetrakis(chloromethyl)-2-oxabicyclo[3.2.2]nonan-3-one
SpectraBase Compound ID 5PpyvbLoCLL
InChI InChI=1S/C12H16Cl4O2/c13-2-7-6-1-11(17)18-12(9(7)4-15)10(5-16)8(6)3-14/h6-10,12H,1-5H2/t6-,7+,8-,9-,10+,12+
InChIKey FZPUFNCAQKLFSY-NLFFJCHRSA-N
Mol Weight 334.1 g/mol
Molecular Formula C12H16Cl4O2
Exact Mass 331.990441 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3kFoQldiJjg
Name (1r,4r,6R,7S,8R,9S)-6,7,8,9-tetrakis(chloromethyl)-2-oxabicyclo[3.2.2]nonan-3-one
Alternate Name(s) (6R,7S,8R,9S)-6,7,8,9-tetrakis(chloromethyl)-2-oxabicyclo[3.2.2]nonan-3-one
CAS Registry Number 113503-47-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16Cl4O2
InChI InChI=1S/C12H16Cl4O2/c13-2-7-6-1-11(17)18-12(9(7)4-15)10(5-16)8(6)3-14/h6-10,12H,1-5H2/t6-,7+,8-,9-,10+,12+
InChIKey FZPUFNCAQKLFSY-NLFFJCHRSA-N
Molecular Weight 334.070 g/mol
SMILES [C@]12([C@]([C@](CCl)([C@]([C@@]([C@]2(CCl)[H])(CCl)[H])(CC(O1)=O)[H])[H])(CCl)[H])[H]
SPLASH splash10-0006-3490000000-674889fcba49a2dde45f
Source of Spectrum H-71-1260-33
Wiley ID 1329002