CID 120378

Brn 0812664

Structural Information

Molecular Formula
C9H14N5O2P
SMILES
COC1=NC=NC(=C1)NP(=O)(N2CC2)N3CC3
InChI
InChI=1S/C9H14N5O2P/c1-16-9-6-8(10-7-11-9)12-17(15,13-2-3-13)14-4-5-14/h6-7H,2-5H2,1H3,(H,10,11,12,15)
InChIKey
QULWVTNGPDDLKP-UHFFFAOYSA-N
Compound name
N-[bis(aziridin-1-yl)phosphoryl]-6-methoxypyrimidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.08852 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.09580 143.8
[M+Na]+ 278.07774 155.7
[M+NH4]+ 273.12234 149.8
[M+K]+ 294.05168 155.4
[M-H]- 254.08124 156.7
[M+Na-2H]- 276.06319 154.9
[M]+ 255.08797 150.8
[M]- 255.08907 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.