CID 131885265

Dtxsid40888561

Structural Information

Molecular Formula
C7H5N3O9Pb2
SMILES
CC1=CC(=CC(=C1O[Pb]O[Pb]O[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
InChI
InChI=1S/C7H6N2O5.NO3.O.2Pb/c1-4-2-5(8(11)12)3-6(7(4)10)9(13)14;2-1(3)4;;;/h2-3,10H,1H3;;;;/q;-1;;2*+1/p-1
InChIKey
BOBMJWCRVVVQKC-UHFFFAOYSA-M
Compound name
(2-methyl-4,6-dinitrophenoxy)-(nitrooxy-lambda2-plumbanyl)oxylead
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

690.9559 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 691.96318 193.5
[M+Na]+ 713.94512 198.7
[M+NH4]+ 708.98972 201.9
[M+K]+ 729.91906 207.2
[M-H]- 689.94862 190.1
[M+Na-2H]- 711.93057 189.9
[M]+ 690.95535 195.5
[M]- 690.95645 195.5
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.