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4-Chloro-2-phenyl-2,5-diazabicyclo[2.2.2[octane-3,6-dione
SpectraBase Compound ID IxtgfKCceio
InChI InChI=1S/C12H11ClN2O2/c13-12-7-6-9(10(16)14-12)15(11(12)17)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,14,16)/t9-,12-/m0/s1
InChIKey HQYOLGGELJBOBQ-CABZTGNLSA-N
Mol Weight 250.68 g/mol
Molecular Formula C12H11ClN2O2
Exact Mass 250.050905 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5XXqytIPDp
Name 4-Chloro-2-phenyl-2,5-diazabicyclo[2.2.2[octane-3,6-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11ClN2O2
InChI InChI=1S/C12H11ClN2O2/c13-12-7-6-9(10(16)14-12)15(11(12)17)8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,14,16)/t9-,12-/m0/s1
InChIKey HQYOLGGELJBOBQ-CABZTGNLSA-N
Molecular Weight 250.685 g/mol
SMILES N1C([C@]2(N(C([C@@]1(CC2)Cl)=O)c1ccccc1)[H])=O
SPLASH splash10-00b9-0960000000-36f7c068f95d7c45020a
Source of Spectrum F-47-9265-3
Synonyms 1-Chloro-5-phenyl-2,5-diazabicyclo[2.2.2]octane-3,6-dione
Wiley ID 1252922