CID 3041199

Phosphonic acid, (2-((aminoacetyl)amino)ethyl)-

Structural Information

Molecular Formula
C4H11N2O4P
SMILES
C(CP(=O)(O)O)NC(=O)CN
InChI
InChI=1S/C4H11N2O4P/c5-3-4(7)6-1-2-11(8,9)10/h1-3,5H2,(H,6,7)(H2,8,9,10)
InChIKey
PKSAIFMBRHCGAH-UHFFFAOYSA-N
Compound name
2-[(2-aminoacetyl)amino]ethylphosphonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.04564 Da
Monoisotopic Mass

-5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.05292 139.0
[M+Na]+ 205.03486 144.4
[M-H]- 181.03836 134.9
[M+NH4]+ 200.07946 156.9
[M+K]+ 221.00880 143.8
[M+H-H2O]+ 165.04290 131.8
[M+HCOO]- 227.04384 165.5
[M+CH3COO]- 241.05949 179.2
[M+Na-2H]- 203.02031 141.3
[M]+ 182.04509 137.5
[M]- 182.04619 137.5
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

patents stripe