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(Z)-2-acetamido-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoic acid
SpectraBase Compound ID 8iwNBXzagSb
InChI InChI=1S/C12H13NO5/c1-7(14)13-9(12(16)17)5-8-3-4-10(15)11(6-8)18-2/h3-6,15H,1-2H3,(H,13,14)(H,16,17)/b9-5-
InChIKey WSQYCAULLNISPN-UITAMQMPSA-N
Mol Weight 251.24 g/mol
Molecular Formula C12H13NO5
Exact Mass 251.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2SKuia6KwjI
Name (Z)-2-acetamido-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoic acid
Alternate Name(s) (Z)-2-acetamido-3-(4-hydroxy-3-methoxy-phenyl)acrylic acid (Z)-2-acetamido-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoic acid (Z)-2-acetamido-3-(4-hydroxy-3-methoxyphenyl)-2-propenoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C12H13NO5
InChI InChI=1S/C12H13NO5/c1-7(14)13-9(12(16)17)5-8-3-4-10(15)11(6-8)18-2/h3-6,15H,1-2H3,(H,13,14)(H,16,17)/b9-5-
InChIKey WSQYCAULLNISPN-UITAMQMPSA-N
Molecular Weight 251.238 g/mol
SMILES Oc1c(cc(\C=C/(C(=O)O)NC(=O)C)cc1)OC
SPLASH splash10-0pb9-0090000000-6ec292ec8cf5f0af31df
Source of Spectrum SO-0-794-4
Wiley ID 1543443