CID 16684176

Acetanilide, 2,6-bis(acetoxymercuri)-4-nitro-

Structural Information

Molecular Formula
C12H12Hg2N2O7
SMILES
CC(=O)NC1=C(C=C(C=C1[Hg]OC(=O)C)[N+](=O)[O-])[Hg]OC(=O)C
InChI
InChI=1S/C8H6N2O3.2C2H4O2.2Hg/c1-6(11)9-7-2-4-8(5-3-7)10(12)13;2*1-2(3)4;;/h4-5H,1H3,(H,9,11);2*1H3,(H,3,4);;/q;;;2*+1/p-2
InChIKey
QUCHGWZIGHVNJS-UHFFFAOYSA-L
Compound name
[2-acetamido-3-(acetyloxymercurio)-5-nitrophenyl]-acetyloxymercury
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

700.00574 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 701.01302 227.5
[M+Na]+ 722.99496 234.6
[M+NH4]+ 718.03956 229.2
[M+K]+ 738.96890 231.8
[M-H]- 698.99846 226.5
[M+Na-2H]- 720.98041 224.9
[M]+ 700.00519 227.4
[M]- 700.00629 227.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.