1,5-Dichloroanthraquinone(82-46-2) MS
Product Name1,5-Dichloroanthraquinone
CAS82-46-2
Molecular FormulaC14H6Cl2O2
Molecular Weight277.1
InChIInChI=1S/C14H6Cl2O2/c15-9-5-1-3-7-11(9)14(18)8-4-2-6-10(16)12(8)13(7)17/h1-6H
InChIKey MQIUMARJCOGCIM-UHFFFAOYSA-N
SmilesC1(Cl)=C2C(C(=O)C3=C(C2=O)C=CC=C3Cl)=CC=C1
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Assign. Shift(ppm)
A 8.167 B 7.938 C 7.867 Assigned with HMQC and HMBC.Spectral Code: 1H NMR : in DMSO-d6
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ppm Int. Assign.
180.42 352 1 136.90 611 2 136.86 910 3 134.58 898 4 132.73 543 5 128.50 481 6 126.48 1000 7 Assigned with HMQC and HMBC.Spectral Code: 13C NMR : in DMSO-d6
