OCTANOPHENONE(1674-37-9) IR1
Product NameOCTANOPHENONE
CAS1674-37-9
Molecular FormulaC14H20O
Molecular Weight204.31
InChIInChI=1S/C14H20O/c1-2-3-4-5-9-12-14(15)13-10-7-6-8-11-13/h6-8,10-11H,2-5,9,12H2,1H3
InChIKey UDEVCZRUNOLVLU-UHFFFAOYSA-N
SmilesC(C1=CC=CC=C1)(=O)CCCCCCC
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Assign. Shift(ppm)
A 7.95 B 7.52 C 7.47 D 2.95 E 1.73 F 1.56 to 1.11 G 0.89Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
200.29 255 1 137.22 234 2 132.81 435 3 128.55 1000 4 * 128.07 870 5 * 38.59 500 6 31.78 375 7 29.39 478 8 # 29.24 500 9 # 24.42 402 10 22.67 380 11 14.09 359 12Spectral Code: 13C NMR : in CDCl3
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Spectral Code: IR : liquid film
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Spectral Code: Raman : 4880 A,150M,liquid
