Product Name HEPTANOPHENONE
CAS1671-75-6
MFC13H18O
MW190.28
InChIInChI=1S/C13H18O/c1-2-3-4-8-11-13(14)12-9-6-5-7-10-12/h5-7,9-10H,2-4,8,11H2,1H3
InChIKeyUXMQORVHJMUQFD-UHFFFAOYSA-N
SmilesC(C1=CC=CC=C1)(=O)CCCCCC
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Assign. Shift(ppm) A 7.95 B 7.52 C 7.48 D 2.95 E 1.74 F 1.55 to 1.15 G 0.90
ppm Int. Assign. 200.26 246 1 137.18 224 2 132.79 388 3 128.50 973 4 * 128.02 1000 5 * 38.53 486 6 31.68 421 7 29.03 410 8 24.31 454 9 22.54 383 10 14.00 366 11
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