CID 100233

Diphenyl n-amidinophosphoramidate

Structural Information

Molecular Formula
C13H14N3O3P
SMILES
C1=CC=C(C=C1)OP(=O)(N=C(N)N)OC2=CC=CC=C2
InChI
InChI=1S/C13H14N3O3P/c14-13(15)16-20(17,18-11-7-3-1-4-8-11)19-12-9-5-2-6-10-12/h1-10H,(H4,14,15,16,17)
InChIKey
DQMWFJKHBOHYTI-UHFFFAOYSA-N
Compound name
2-diphenoxyphosphorylguanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

291.07727 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.08455 166.0
[M+Na]+ 314.06649 175.2
[M+NH4]+ 309.11109 172.0
[M+K]+ 330.04043 170.6
[M-H]- 290.06999 169.7
[M+Na-2H]- 312.05194 173.5
[M]+ 291.07672 167.9
[M]- 291.07782 167.9
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.