CID 3033971

321-35-7

Structural Information

Molecular Formula
C14H16FN2OP
SMILES
CN(C1=CC=CC=C1)P(=O)(N(C)C2=CC=CC=C2)F
InChI
InChI=1S/C14H16FN2OP/c1-16(13-9-5-3-6-10-13)19(15,18)17(2)14-11-7-4-8-12-14/h3-12H,1-2H3
InChIKey
IEQCSXWXMOVAKJ-UHFFFAOYSA-N
Compound name
N-[fluoro-(N-methylanilino)phosphoryl]-N-methylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

278.09842 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 279.10570 162.8
[M+Na]+ 301.08764 173.9
[M+NH4]+ 296.13224 170.4
[M+K]+ 317.06158 167.8
[M-H]- 277.09114 166.6
[M+Na-2H]- 299.07309 171.9
[M]+ 278.09787 165.3
[M]- 278.09897 165.3
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.