CID 215643

Brn 0427544

Structural Information

Molecular Formula
C9H11Cl2N4OP
SMILES
C1CN1P(=O)(NC2=C(C=NC=C2Cl)Cl)N3CC3
InChI
InChI=1S/C9H11Cl2N4OP/c10-7-5-12-6-8(11)9(7)13-17(16,14-1-2-14)15-3-4-15/h5-6H,1-4H2,(H,12,13,16)
InChIKey
WWSVOTKXSOIAKA-UHFFFAOYSA-N
Compound name
N-[bis(aziridin-1-yl)phosphoryl]-3,5-dichloropyridin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.00476 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.01204 141.0
[M+Na]+ 314.99398 154.6
[M+NH4]+ 310.03858 148.3
[M+K]+ 330.96792 152.8
[M-H]- 290.99748 154.3
[M+Na-2H]- 312.97943 152.9
[M]+ 292.00421 148.9
[M]- 292.00531 148.9
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.