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3-[5-Cyano-8,9-dihydro-7H-1,3-dioxolo[4,5-h]benzazepin-6-yl]propenoic acid
SpectraBase Compound ID 5rna7xMVhV7
InChI InChI=1S/C15H14N2O4/c16-8-17-11(4-5-15(18)19)3-1-2-10-6-13-14(7-12(10)17)21-9-20-13/h4-7,11H,1-3,9H2,(H,18,19)/b5-4+
InChIKey UVOGGENCLHIEKZ-SNAWJCMRSA-N
Mol Weight 286.29 g/mol
Molecular Formula C15H14N2O4
Exact Mass 286.095357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FBOyiC9TPs2
Name 3-[5-Cyano-8,9-dihydro-7H-1,3-dioxolo[4,5-h]benzazepin-6-yl]propenoic acid
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Formula C15H14N2O4
InChI InChI=1S/C15H14N2O4/c16-8-17-11(4-5-15(18)19)3-1-2-10-6-13-14(7-12(10)17)21-9-20-13/h4-7,11H,1-3,9H2,(H,18,19)/b5-4+
InChIKey UVOGGENCLHIEKZ-SNAWJCMRSA-N
Molecular Weight 286.287 g/mol
SMILES OC(\C=C\C1N(c2c(CCC1)cc1c(c2)OCO1)C#N)=O
SPLASH splash10-000i-0490000000-56236aaa6413a9833832
Source of Spectrum F-69-4349-6
Synonyms (2E)-3-(5-cyano-6,7,8,9-tetrahydro-5H-[1,3]dioxolo[4,5-h][1]benzazepin-6-yl)-2-propenoic acid
Wiley ID 1595190