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(2E)-[ring-D5,1,2-13C2]Cinnamic acid ethyl ester
SpectraBase Compound ID 5wIb8K7FZA8
InChI InChI=1S/C11H12O2/c1-2-13-11(12)9-8-10-6-4-3-5-7-10/h3-9H,2H2,1H3/b9-8+/i3D,4D,5D,6D,7D,9+1,11+1
InChIKey KBEBGUQPQBELIU-FHZDQITJSA-N
Mol Weight 183.23 g/mol
Molecular Formula C913C2H7D5O2
Exact Mass 183.121823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AQlrNh5xKK6
Name (2E)-[ring-D5,1,2-13C2]Cinnamic acid ethyl ester
Comments Original formula: C9[13C]2H7D5O2
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Formula C11H12O2
InChI InChI=1S/C11H12O2/c1-2-13-11(12)9-8-10-6-4-3-5-7-10/h3-9H,2H2,1H3/b9-8+/i3D,4D,5D,6D,7D,9+1,11+1
InChIKey KBEBGUQPQBELIU-FHZDQITJSA-N
Molecular Weight 183.230 g/mol
SMILES c1(\C=[13CH]\[13C](=O)OCC)c(c([D])c(c(c1[D])[D])[D])[D]
SPLASH splash10-052r-1900000000-e93c9ab3b7731463141b
Source of Spectrum F-56-9119-8
Wiley ID 859222