CID 3964633

66515-29-5

Structural Information

Molecular Formula
C4H10NO6P
SMILES
CC(COP(=O)(O)O)(C(=O)O)N
InChI
InChI=1S/C4H10NO6P/c1-4(5,3(6)7)2-11-12(8,9)10/h2,5H2,1H3,(H,6,7)(H2,8,9,10)
InChIKey
GSFCOAGADOGIGE-UHFFFAOYSA-N
Compound name
2-amino-2-methyl-3-phosphonooxypropanoic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

29
References

538
Patents

199.02457 Da
Monoisotopic Mass

-5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.03185 140.7
[M+Na]+ 222.01379 146.7
[M-H]- 198.01729 135.5
[M+NH4]+ 217.05839 157.5
[M+K]+ 237.98773 146.8
[M+H-H2O]+ 182.02183 134.6
[M+HCOO]- 244.02277 163.6
[M+CH3COO]- 258.03842 177.2
[M+Na-2H]- 219.99924 144.0
[M]+ 199.02402 140.6
[M]- 199.02512 140.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe