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 163.0
[M+Na]+ 301.08764 168.1
[M-H]- 277.09114 169.6
[M+NH4]+ 296.13224 179.5
[M+K]+ 317.06158 166.8
[M+H-H2O]+ 261.09568 151.4
[M+HCOO]- 323.09662 193.1
[M+CH3COO]- 337.11227 209.9
[M+Na-2H]- 299.07309 166.2
[M]+ 278.09787 163.4
[M]- 278.09897 163.4
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.