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(E)-3-amino-2-cyano-3-(phenoxy)acrylic acid methyl ester
SpectraBase Compound ID 8gM0QHaRZ0c
InChI InChI=1S/C11H10N2O3/c1-15-11(14)9(7-12)10(13)16-8-5-3-2-4-6-8/h2-6H,13H2,1H3/b10-9+
InChIKey RMHWKVOPBDAREF-MDZDMXLPSA-N
Mol Weight 218.21 g/mol
Molecular Formula C11H10N2O3
Exact Mass 218.069142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CmLybmeJ6NS
Name (E)-3-amino-2-cyano-3-phenoxy-2-propenoic acid methyl ester
Alternate Name(s) (E)-3-amino-2-cyano-3-phenoxy-acrylic acid methyl ester methyl (E)-3-amino-2-cyano-3-phenoxy-prop-2-enoate methyl (E)-3-azanyl-2-cyano-3-phenoxy-prop-2-enoate
CAS Registry Number 114907-90-3
Comments Less than 3 mono-isotopic peaks
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Formula C11H10N2O3
InChI InChI=1S/C11H10N2O3/c1-15-11(14)9(7-12)10(13)16-8-5-3-2-4-6-8/h2-6H,13H2,1H3/b10-9+
InChIKey RMHWKVOPBDAREF-MDZDMXLPSA-N
Molecular Weight 218.212 g/mol
SMILES N\C(=C/(C(=O)OC)C#N)Oc1ccccc1
SPLASH splash10-0006-9020000000-9a9f1a186cbad38dc797
Source of Spectrum K-121-1821-3
Wiley ID 1217333