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Product Name3-NIRO-O-XYLENE
CAS616-69-3
Molecular FormulaC8H8N2O4
Molecular Weight196.16
InChIInChI=1S/C8H8N2O4/c1-5-3-7(9(11)12)4-8(6(5)2)10(13)14/h3-4H,1-2H3
InChIKey FHCBGLKAGXVKHS-UHFFFAOYSA-N
SmilesC1(C)=CC([N+]([O-])=O)=CC([N+]([O-])=O)=C1C
1HNMR
13CNMR
IR1
Raman
Assign. Shift(ppm) A 8.448 B 8.240 C 2.53 D 2.51
ppm Int. Assign. 150.81 145 1 145.40 210 2 142.05 725 3 * 138.27 645 4 * 127.34 980 5 117.05 865 6 20.89 1000 7 15.88 925 8
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3-NIRO-O-XYLENE(616-69-3) 1H NMR Atlas of Related Products