Cinnamylcetate(21040-45-9) IR1
Product NameCinnamylcetate
CAS21040-45-9
Molecular FormulaC11H12O2
Molecular Weight176.21
InChIInChI=1S/C11H12O2/c1-10(12)13-9-5-8-11-6-3-2-4-7-11/h2-8H,9H2,1H3/b8-5+
InChIKey WJSDHUCWMSHDCR-VMPITWQZSA-N
SmilesC(OC(=O)C)/C=C/C1=CC=CC=C1
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Assign. Shift(ppm)
A 7.53 to 7.09 B 6.62 C 6.29 D 4.72 E 2.081Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
170.58 177 1 136.25 261 2 134.10 438 3 128.59 1000 4 128.03 355 5 126.61 867 6 123.25 369 7 64.96 414 8 20.86 266 9Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : liquid film
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Spectral Code: Raman : 4880 A,200 M,liquid
