CID 200923

Brn 0548344

Structural Information

Molecular Formula
C10H16N5O2P
SMILES
CC1=CC(=NC(=N1)NP(=O)(N2CC2)N3CC3)OC
InChI
InChI=1S/C10H16N5O2P/c1-8-7-9(17-2)12-10(11-8)13-18(16,14-3-4-14)15-5-6-15/h7H,3-6H2,1-2H3,(H,11,12,13,16)
InChIKey
WEDYVLGJVHLAAL-UHFFFAOYSA-N
Compound name
N-[bis(aziridin-1-yl)phosphoryl]-4-methoxy-6-methylpyrimidin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

269.10416 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.11144 191.7
[M+Na]+ 292.09338 199.5
[M-H]- 268.09688 195.1
[M+NH4]+ 287.13798 192.6
[M+K]+ 308.06732 194.7
[M+H-H2O]+ 252.10142 181.0
[M+HCOO]- 314.10236 212.6
[M+CH3COO]- 328.11801 209.7
[M+Na-2H]- 290.07883 191.0
[M]+ 269.10361 196.0
[M]- 269.10471 196.0
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

No patent data available for this compound.