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5-(3-AMINO-4-HYDROXYPHENYL)-(2-E,4-E)-[1,2-(13)-C2]-PENTA-2,4-DIENOIC_ACID
SpectraBase Compound ID CWSCntWZDzQ
InChI InChI=1S/C11H11NO3/c12-9-7-8(5-6-10(9)13)3-1-2-4-11(14)15/h1-7,13H,12H2,(H,14,15)/b3-1+,4-2+/i4+1,11+1
InChIKey WVBIXHAMNDUEIA-VWUCHSGASA-N
Mol Weight 207.2 g/mol
Molecular Formula C913C2H11NO3
Exact Mass 207.080603 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BRKiToK23cH
Name 5-(3-AMINO-4-HYDROXYPHENYL)-(2-E,4-E)-[1,2-(13)-C2]-PENTA-2,4-DIENOIC_ACID
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H11NO3
InChI InChI=1S/C11H11NO3/c12-9-7-8(5-6-10(9)13)3-1-2-4-11(14)15/h1-7,13H,12H2,(H,14,15)/b3-1+,4-2+/i4+1,11+1
InChIKey WVBIXHAMNDUEIA-VWUCHSGASA-N
Literature Reference Author Y.HU,H.G.FLOSS
Literature Reference Citation J.AM.CHEM.SOC.,126,3837(2004)
Literature Reference DOI 10.1021/ja039336+
Molecular Weight 205.213 g/mol
Solvent DMSO-D6
Source File Reference UWMZ24432