(3Z)-3-己烯-1-醇-2-氨基苯甲酸酯(65405-76-7)Raman光譜
分子式:C13H17NO2
分子量: 219.28
InChI:InChI=1S/C13H17NO2/c1-2-3-4-7-10-16-13(15)11-8-5-6-9-12(11)14/h3-6,8-9H,2,7,10,14H2,1H3/b4-3-
InChIKey: VZWCCPAVZNSCEO-ARJAWSKDSA-N
Smiles:C(OC(=O)C1=CC=CC=C1N)C/C=C\CC
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Assign. Shift(ppm)
A 7.85
B 7.24
C 6.64
D 6.63
E *1 5.54
F 5.46
G *1 5.39
J 4.26
K 2.50
L 2.09
M 0.98
Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
168.12 463 1
150.57 602 2
134.52 826 3 *
133.99 925 4 *
131.25 1000 5
123.96 960 6
116.66 891 7 #
116.15 925 8 #
110.95 552 9
63.84 746 10
26.92 632 11
20.66 756 12
14.23 552 13
Spectral 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