CID 120353

726-89-6

Structural Information

Molecular Formula
C11H13FN3O2P
SMILES
C1CN1P(=O)(NC(=O)C2=CC=CC=C2F)N3CC3
InChI
InChI=1S/C11H13FN3O2P/c12-10-4-2-1-3-9(10)11(16)13-18(17,14-5-6-14)15-7-8-15/h1-4H,5-8H2,(H,13,16,17)
InChIKey
AKKGKFFPKQHFMW-UHFFFAOYSA-N
Compound name
N-[bis(aziridin-1-yl)phosphoryl]-2-fluorobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

269.07294 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.08022 145.6
[M+Na]+ 292.06216 155.9
[M+NH4]+ 287.10676 151.5
[M+K]+ 308.03610 155.8
[M-H]- 268.06566 157.8
[M+Na-2H]- 290.04761 155.8
[M]+ 269.07239 152.0
[M]- 269.07349 152.0
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

patents stripe