CID 67611

N,n'-diphenylphosphorodiamidic fluoride

Structural Information

Molecular Formula
C12H12FN2OP
SMILES
C1=CC=C(C=C1)NP(=O)(NC2=CC=CC=C2)F
InChI
InChI=1S/C12H12FN2OP/c13-17(16,14-11-7-3-1-4-8-11)15-12-9-5-2-6-10-12/h1-10H,(H2,14,15,16)
InChIKey
FPLZAICQNAEAND-UHFFFAOYSA-N
Compound name
N-[anilino(fluoro)phosphoryl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.06712 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.07440 153.7
[M+Na]+ 273.05634 159.4
[M-H]- 249.05984 157.6
[M+NH4]+ 268.10094 170.1
[M+K]+ 289.03028 155.6
[M+H-H2O]+ 233.06438 142.9
[M+HCOO]- 295.06532 183.5
[M+CH3COO]- 309.08097 197.1
[M+Na-2H]- 271.04179 159.4
[M]+ 250.06657 150.8
[M]- 250.06767 150.8
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.