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2-(E-Cinnamido)-1,4-benzoquinone
SpectraBase Compound ID 7xKV9WtWxG9
InChI InChI=1S/C15H11NO3/c17-12-7-8-14(18)13(10-12)16-15(19)9-6-11-4-2-1-3-5-11/h1-10H,(H,16,19)/b9-6+
InChIKey MSJGXKUMSGFBJF-RMKNXTFCSA-N
Mol Weight 253.26 g/mol
Molecular Formula C15H11NO3
Exact Mass 253.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 52EDD7WlrgL
Name 2-(E-Cinnamido)-1,4-benzoquinone
Alternate Name(s) (2E)-N-(3,6-dioxo-1,4-cyclohexadien-1-yl)-3-phenyl-2-propenamide (E)-N-(3,6-dioxo-1-cyclohexa-1,4-dienyl)-3-phenyl-2-propenamide (E)-N-(3,6-dioxocyclohexa-1,4-dien-1-yl)-3-phenylprop-2-enamide (E)-N-(3,6-dioxocyclohexa-1,4-dien-1-yl)-3-phenyl-prop-2-enamide (E)-N-[3,6-bis(oxidanylidene)cyclohexa-1,4-dien-1-yl]-3-phenyl-prop-2-enamide
Comments Less than 3 mono-isotopic peaks
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Formula C15H11NO3
InChI InChI=1S/C15H11NO3/c17-12-7-8-14(18)13(10-12)16-15(19)9-6-11-4-2-1-3-5-11/h1-10H,(H,16,19)/b9-6+
InChIKey MSJGXKUMSGFBJF-RMKNXTFCSA-N
Molecular Weight 253.257 g/mol
SMILES N(C1=CC(=O)C=CC1=O)C(\C=C\c1ccccc1)=O
SPLASH splash10-001i-0900000000-8aacc8c41af199aec000
Source of Spectrum SO-0-786-40
Wiley ID 875553