2-庚基環(huán)戊酮(137-03-1)紅外圖譜(IR1)
InChI:InChI=1S/C12H22O/c1-2-3-4-5-6-8-11-9-7-10-12(11)13/h11H,2-10H2,1H3
InChIKey: PJXHBTZLHITWFX-UHFFFAOYSA-N
Smiles:C1(=O)CCCC1CCCCCCC
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ppm Int. Assign.
221.30 350 1
49.18 590 2
38.19 605 3
31.90 580 4
29.78 640 5 *
29.66 1000 6 *
7 *
29.23 665 8 *
27.65 645 9
22.71 655 10
20.83 580 11
14.11 595 12
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