1-PHENYL-2-PENTANONE(6683-92-7) Raman
Product Name1-PHENYL-2-PENTANONE
CAS6683-92-7
Molecular FormulaC11H14O
Molecular Weight162.23
InChIInChI=1S/C11H14O/c1-2-6-11(12)9-10-7-4-3-5-8-10/h3-5,7-8H,2,6,9H2,1H3
InChIKey NFKAWBGFIMBUMB-UHFFFAOYSA-N
SmilesC(C1=CC=CC=C1)C(=O)CCC
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Assign. Shift(ppm)
A 7.49 to 7.02 B 3.66 C 2.41 D 1.57 E 0.87Spectral Code: 1H NMR : 90 MHz in CDCl3
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ppm Int. Assign.
208.09 262 1 134.46 252 2 129.42 924 3 * 128.66 1000 4 * 126.91 524 5 50.10 548 6 43.86 443 7 17.20 429 8 13.64 405 9Spectral 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
