Product NameCIS-1-HYDROXY-2-INDANYLFORMATE
Molecular FormulaC10H10O3
Molecular Weight178.1846
InChIInChI=1/C10H10O3/c11-9-7-4-2-1-3-6(7)5-8(9)10(12)13/h1-4,8-9,11H,5H2,(H,12,13)/t8-,9+/s3
InChIKey QUSWUVSTSROYCQ-MASDURLHNA-N
SmilesC([C@H]1CC2=C([C@H]1O)C=CC=C2)(O)=O |&1:1,5,r|
Assign. Shift(ppm)
A 8.241 B 7.33 C 7.24 to 7.19 D 5.57 E 5.42 F 5.089 G *1 3.137 J *1 2.937 ASSIGNED BY H-H AND C-H COSY. J(D,F)=7.2HZ J(E,F)=5.6HZ J(E,G)=5.6HZ J(E,J)=2.9HZ J(G,J)=-16.6HZ
ppm Int. Assign.
162.00 850 1 143.02 599 2 138.83 712 3 127.79 905 4 126.64 1000 5 124.55 929 6 * 124.27 912 7 * 76.19 804 8 73.61 965 9 35.30 933 10
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