CID 4432411

Diphosphoryl chloride

Structural Information

Molecular Formula
Cl4O3P2
SMILES
O=P(OP(=O)(Cl)Cl)(Cl)Cl
InChI
InChI=1S/Cl4O3P2/c1-8(2,5)7-9(3,4)6
InChIKey
CNTIXUGILVWVHR-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

767
Patents

249.80768 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.814956 134.4
[M+Na]+ 272.796898 145.8
[M-H]- 248.800404 132.3
[M+NH4]+ 267.841503 153.9
[M+K]+ 288.770838 141.6
[M+H-H2O]+ 232.804940 130.8
[M+HCOO]- 294.805881 147.6
[M+CH3COO]- 308.821531 189.0
[M+Na-2H]- 270.782346 138.1
[M]+ 249.80713142 139.9
[M]- 249.80822858 139.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe