CID 86194613

(2-azidoethyl)phosphonic acid

Structural Information

Molecular Formula

C₂H₆N₃O₃P

SMILES

C(CP(=O)(O)O)N=[N+]=[N-]

InChI

InChI=1S/C2H6N3O3P/c3-5-4-1-2-9(6,7)8/h1-2H2,(H2,6,7,8)

InChIKey

VACJQMCGWFXYNG-UHFFFAOYSA-N

Compound name

2-azidoethylphosphonic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 151.01468 Da
Monoisotopic Mass: -0.7
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]+	152.02196	124.2
[M+Na]+	174.00390	131.2
[M-H]-	150.00740	124.1
[M+NH4]+	169.04850	144.7
[M+K]+	189.97784	126.9
[M+H-H2O]+	134.01194	122.1
[M+HCOO]-	196.01288	157.7
[M+CH3COO]-	210.02853	171.1
[M+Na-2H]-	171.98935	134.3
[M]+	151.01413	122.7
[M]-	151.01523	122.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe