CID 14556192

Gmppt

Structural Information

Molecular Formula
C6H14NO4P
SMILES
CC(CC(C(=O)O)N)P(=O)(C)O
InChI
InChI=1S/C6H14NO4P/c1-4(12(2,10)11)3-5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)(H,10,11)
InChIKey
LLSWVOXJHFIPIU-UHFFFAOYSA-N
Compound name
2-amino-4-[hydroxy(methyl)phosphoryl]pentanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

56
Patents

195.06604 Da
Monoisotopic Mass

-3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.073316 145.3
[M+Na]+ 218.055258 150.4
[M-H]- 194.058764 141.2
[M+NH4]+ 213.099863 163.0
[M+K]+ 234.029198 150.4
[M+H-H2O]+ 178.063300 138.7
[M+HCOO]- 240.064241 168.3
[M+CH3COO]- 254.079891 182.4
[M+Na-2H]- 216.040706 143.9
[M]+ 195.06549142 144.3
[M]- 195.06658858 144.3
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

patents stripe