Product Name2-Ethylphenethyl(phenyl) sulfide
Molecular FormulaC32H34S
Molecular Weight450.67736
InChIInChI=1S/C32H34S/c1-3-25-13-5-7-15-27(25)21-23-29-17-9-11-19-31(29)33-32-20-12-10-18-30(32)24-22-28-16-8-6-14-26(28)4-2/h5-20H,3-4,21-24H2,1-2H3
InChIKey JDTXDFRMIPSMSW-UHFFFAOYSA-N
SmilesS(C1=CC=CC=C1CCC1=CC=CC=C1CC)C1=CC=CC=C1CCC1=CC=CC=C1CC
Assign. Shift(ppm)
A 7.371 B 7.289 C 7.18 D *1 7.18 E *1 7.17 F *2 7.14 G *2 7.13 J 3.11 K 2.93 L 2.586 M 1.170
ppm Int. Assign.
142.03 258 1 137.87 245 2 136.68 175 3 129.77 787 4 129.36 381 5 128.95 1000 6 128.70 314 7 126.85 375 8 126.17 587 9 * 126.10 431 10 * 35.08 333 11 32.79 307 12 25.59 416 13 15.40 281 14
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