CID 41193

54805-65-1

Structural Information

Molecular Formula
C9H16N3O5P
SMILES
CCOC(=O)N(OC(=O)C)P(=O)(N1CC1)N2CC2
InChI
InChI=1S/C9H16N3O5P/c1-3-16-9(14)12(17-8(2)13)18(15,10-4-5-10)11-6-7-11/h3-7H2,1-2H3
InChIKey
IATZQORMMQOVAJ-UHFFFAOYSA-N
Compound name
[bis(aziridin-1-yl)phosphoryl-ethoxycarbonylamino] acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.08276 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.09004 144.8
[M+Na]+ 300.07198 153.2
[M+NH4]+ 295.11658 149.5
[M+K]+ 316.04592 155.6
[M-H]- 276.07548 155.2
[M+Na-2H]- 298.05743 152.3
[M]+ 277.08221 150.3
[M]- 277.08331 150.3
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.