CID 541499

24569-83-3

Structural Information

Molecular Formula

C₄H₁₀NO₅P

SMILES

CN(CC(=O)O)CP(=O)(O)O

InChI

InChI=1S/C4H10NO5P/c1-5(2-4(6)7)3-11(8,9)10/h2-3H2,1H3,(H,6,7)(H2,8,9,10)

InChIKey

SGVDYFNFBJGOHB-UHFFFAOYSA-N

Compound name

2-[methyl(phosphonomethyl)amino]acetic acid

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 1449
Patents: 183.02966 Da
Monoisotopic Mass: -4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	184.036936	137.3
[M+Na]+	206.018878	143.3
[M-H]-	182.022384	133.9
[M+NH4]+	201.063483	155.7
[M+K]+	221.992818	144.1
[M+H-H2O]+	166.026920	130.7
[M+HCOO]-	228.027861	162.8
[M+CH3COO]-	242.043511	178.2
[M+Na-2H]-	204.004326	139.5
[M]+	183.02911142	138.7
[M]-	183.03020858	138.7

Literature stripe

literature stripe

Patent stripe

patents stripe