CID 440763

2-amino-4-selenobutanoic acid

Structural Information

Molecular Formula
C4H9NO2Se
SMILES
C(C[SeH])C(C(=O)O)N
InChI
InChI=1S/C4H9NO2Se/c5-3(1-2-8)4(6)7/h3,8H,1-2,5H2,(H,6,7)
InChIKey
RCWCGLALNCIQNM-UHFFFAOYSA-N
Compound name
2-amino-4-selanylbutanoic acid
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

52
Patents

182.97984 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.98712 133.7
[M+Na]+ 205.96906 141.4
[M+NH4]+ 201.01366 140.3
[M+K]+ 221.94300 137.8
[M-H]- 181.97256 132.0
[M+Na-2H]- 203.95451 135.2
[M]+ 182.97929 133.8
[M]- 182.98039 133.8
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.