CID 3323167

(s)-serinol phosphate

Structural Information

Molecular Formula

C₃H₁₀NO₅P

SMILES

C(C(COP(=O)(O)O)N)O

InChI

InChI=1S/C3H10NO5P/c4-3(1-5)2-9-10(6,7)8/h3,5H,1-2,4H2,(H2,6,7,8)

InChIKey

WDWYJNPKBKWDBL-UHFFFAOYSA-N

Compound name

(2-amino-3-hydroxypropyl) dihydrogen phosphate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 310
Patents: 171.02966 Da
Monoisotopic Mass: -5.4
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]+	172.03694	135.8
[M+Na]+	194.01888	141.6
[M-H]-	170.02238	130.4
[M+NH4]+	189.06348	153.7
[M+K]+	209.99282	141.5
[M+H-H2O]+	154.02692	129.2
[M+HCOO]-	216.02786	160.1
[M+CH3COO]-	230.04351	172.3
[M+Na-2H]-	192.00433	137.9
[M]+	171.02911	135.1
[M]-	171.03021	135.1

Literature stripe

literature stripe

Patent stripe

patents stripe