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(2E,4E)-5-iodanyl-1-pyrrolidin-1-yl-penta-2,4-dien-1-one
SpectraBase Compound ID ADoPtocAvf8
InChI InChI=1S/C9H12INO/c10-6-2-1-5-9(12)11-7-3-4-8-11/h1-2,5-6H,3-4,7-8H2/b5-1+,6-2+
InChIKey JRQGRMCKOOZAAN-IJIVKGSJSA-N
Mol Weight 277.11 g/mol
Molecular Formula C9H12INO
Exact Mass 276.996359 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Efg9rrOrBuW
Name (2E,4E)-5-iodanyl-1-pyrrolidin-1-yl-penta-2,4-dien-1-one
Alternate Name(s) (2E,4E)-5-iodo-1-(1-pyrrolidinyl)-1-penta-2,4-dienone (2E,4E)-5-iodo-1-pyrrolidin-1-yl-penta-2,4-dien-1-one (2E,4E)-5-iodo-1-pyrrolidino-penta-2,4-dien-1-one
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Formula C9H12INO
InChI InChI=1S/C9H12INO/c10-6-2-1-5-9(12)11-7-3-4-8-11/h1-2,5-6H,3-4,7-8H2/b5-1+,6-2+
InChIKey JRQGRMCKOOZAAN-IJIVKGSJSA-N
Molecular Weight 277.105 g/mol
SMILES C(N1CCCC1)(\C=C\C=C\I)=O
SPLASH splash10-0udi-5950000000-e5c69c503b5100417681
Source of Spectrum AT-35-2070-5
Wiley ID 852674