正丁基苯甲酸对乙氧基苯酯
产品名称
正丁基苯甲酸对乙氧基苯酯
CAS号62716-65-8
分子式C19H22O3
分子量298.38
InChIInChI=1S/C19H22O3/c1-3-5-6-15-7-9-16(10-8-15)19(20)22-18-13-11-17(12-14-18)21-4-2/h7-14H,3-6H2,1-2H3
InChIKeyDDDWTNWRNNRWNQ-UHFFFAOYSA-N
SmilesC(OC1=CC=C(OCC)C=C1)(=O)C1=CC=C(CCCC)C=C1
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Assign. Shift(ppm)
A 8.09
B 7.29
C 7.09
D 6.92
E 4.021
F 2.68
G 1.64
J 1.412
K 1.36
L 0.94
Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
165.52 365 1
156.66 435 2
149.14 625 3
144.47 440 4
130.21 920 5
128.61 910 6
127.20 530 7
122.46 1000 8
115.09 985 9
63.82 425 10
35.77 440 11
33.27 460 12
22.33 425 13
14.85 335 14
13.90 395 15
Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : nujol mull
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Spectral Code: Raman : 4880 A,200 M,powder
正丁基苯甲酸对乙氧基苯酯(62716-65-8)Raman光谱 相关产品图谱