3-Methoxycinnamic acid(6099-04-3) 13C NMR
Product Name3-Methoxycinnamic acid
CAS6099-04-3
Molecular FormulaC10H10O3
Molecular Weight178.18
InChIInChI=1S/C10H10O3/c1-13-9-4-2-3-8(7-9)5-6-10(11)12/h2-7H,1H3,(H,11,12)
InChIKey LZPNXAULYJPXEH-UHFFFAOYSA-N
SmilesC(O)(=O)C=CC1=CC=CC(OC)=C1
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Assign. Shift(ppm)
A 11.72 B 7.748 C 7.29 D 7.11 E 7.05 F 6.96 G 6.439 J 3.824Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
172.63 744 1 159.98 750 2 146.99 667 3 135.45 900 4 129.94 922 5 121.08 878 6 117.69 1000 7 116.63 650 8 113.31 928 9 55.25 978 10Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : KBr disc
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Spectral Code: Raman : 4880 A,200 M,powder
