CID 72904

P-phenylphosphonic diamide

Structural Information

Molecular Formula
C6H9N2OP
SMILES
C1=CC=C(C=C1)P(=O)(N)N
InChI
InChI=1S/C6H9N2OP/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H4,7,8,9)
InChIKey
SIZHJVYZJFWGHF-UHFFFAOYSA-N
Compound name
diaminophosphorylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

153
Patents

156.04524 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.05252 132.2
[M+Na]+ 179.03446 139.3
[M-H]- 155.03796 134.0
[M+NH4]+ 174.07906 152.5
[M+K]+ 195.00840 137.4
[M+H-H2O]+ 139.04250 124.4
[M+HCOO]- 201.04344 162.4
[M+CH3COO]- 215.05909 179.1
[M+Na-2H]- 177.01991 137.0
[M]+ 156.04469 129.0
[M]- 156.04579 129.0
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