4-羟基苯甲酸正壬酯
产品名称
4-羟基苯甲酸正壬酯
CAS号38713-56-3
分子式C16H24O3
分子量264.36
InChIInChI=1S/C16H24O3/c1-2-3-4-5-6-7-8-13-19-16(18)14-9-11-15(17)12-10-14/h9-12,17H,2-8,13H2,1H3
InChIKeyMBNSKHJDYXPONL-UHFFFAOYSA-N
SmilesC(OCCCCCCCCC)(=O)C1=CC=C(O)C=C1
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Assign. Shift(ppm)
A 7.95
B 6.90
C 6.90
D 4.293
E 1.76
F 1.55 to 1.12
G 0.88
Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
167.76 638 1
160.95 950 2
132.01 1000 3
122.09 765 4
115.46 864 5
65.45 367 6
31.89 498 7
29.51 538 8 *
29.29 751 9 *
10
28.74 443 11
26.06 466 12
22.69 502 13
14.11 425 14
Spectral 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
4-羟基苯甲酸正壬酯(38713-56-3)核磁图(13CNMR) 相关产品图谱