Product Name 4-Isopropylbenzoic acid
CAS536-66-3
MFC10H12O2
MW164.2
InChIInChI=1S/C10H12O2/c1-7(2)8-3-5-9(6-4-8)10(11)12/h3-7H,1-2H3,(H,11,12)
InChIKeyCKMXAIVXVKGGFM-UHFFFAOYSA-N
SmilesC(O)(=O)C1=CC=C(C(C)C)C=C1
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Assign. Shift(ppm) A 12.52 B 8.05 C 7.32 D 2.97 E 1.276
ppm Int. Assign. 172.64 199 1 155.42 403 2 130.50 914 3 127.15 409 4 126.65 1000 5 34.41 640 6 23.67 957 7
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