2-甲基-3-庚酮
产品名称
2-甲基-3-庚酮
CAS号13019-20-0
分子式C8H16O
分子量128.21
InChIInChI=1S/C8H16O/c1-4-5-6-8(9)7(2)3/h7H,4-6H2,1-3H3
InChIKeyXYYMFUCZDNNGFS-UHFFFAOYSA-N
SmilesCC(C)C(=O)CCCC
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Assign. Shift(ppm)
A 2.53
B 2.44
C 1.56
D 1.35
E 1.089
F 0.92
Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
214.87 222 1
40.88 649 2 *
40.12 654 3 *
26.05 600 4
22.53 503 5
18.29 1000 6
13.90 519 7
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
2-甲基-3-庚酮(13019-20-0)红外图谱(IR1) 相关产品图谱