CID 200784

Brn 0687569

Structural Information

Molecular Formula
C10H16N5O3P
SMILES
COC1=NC(=NC(=C1)NP(=O)(N2CC2)N3CC3)OC
InChI
InChI=1S/C10H16N5O3P/c1-17-9-7-8(11-10(12-9)18-2)13-19(16,14-3-4-14)15-5-6-15/h7H,3-6H2,1-2H3,(H,11,12,13,16)
InChIKey
KXAVRWZATBENFO-UHFFFAOYSA-N
Compound name
N-[bis(aziridin-1-yl)phosphoryl]-2,6-dimethoxypyrimidin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.0991 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.10638 194.6
[M+Na]+ 308.08832 202.3
[M-H]- 284.09182 198.0
[M+NH4]+ 303.13292 194.9
[M+K]+ 324.06226 197.7
[M+H-H2O]+ 268.09636 183.9
[M+HCOO]- 330.09730 215.6
[M+CH3COO]- 344.11295 211.5
[M+Na-2H]- 306.07377 194.0
[M]+ 285.09855 200.1
[M]- 285.09965 200.1
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.