CID 5951

L-serine

Structural Information

Molecular Formula
C3H7NO3
SMILES
C([C@@H](C(=O)O)N)O
InChI
InChI=1S/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1
InChIKey
MTCFGRXMJLQNBG-REOHCLBHSA-N
Compound name
(2S)-2-amino-3-hydroxypropanoic acid
Related CIDs

2D Structure

compound 2d structure
10
Annotation Hits

61749
References

175654
Patents

105.042595 Da
Monoisotopic Mass

-3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 106.04987 119.2
[M+Na]+ 128.03181 125.7
[M-H]- 104.03532 116.6
[M+NH4]+ 123.07642 140.0
[M+K]+ 144.00575 125.7
[M+H-H2O]+ 88.039855 114.9
[M+HCOO]- 150.04080 140.2
[M+CH3COO]- 164.05645 163.9
[M+Na-2H]- 126.01726 123.2
[M]+ 105.04205 115.9
[M]- 105.04314 115.9
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

No patent data available for this compound.