CID 136456

2,3-dihydroxybutanediamide

Structural Information

Molecular Formula
C4H8N2O4
SMILES
C(C(C(=O)N)O)(C(=O)N)O
InChI
InChI=1S/C4H8N2O4/c5-3(9)1(7)2(8)4(6)10/h1-2,7-8H,(H2,5,9)(H2,6,10)
InChIKey
GRMNJXQBRPJVQV-UHFFFAOYSA-N
Compound name
2,3-dihydroxybutanediamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

2864
Patents

148.0484 Da
Monoisotopic Mass

-3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.05568 129.6
[M+Na]+ 171.03762 134.5
[M-H]- 147.04112 126.3
[M+NH4]+ 166.08222 147.6
[M+K]+ 187.01156 134.9
[M+H-H2O]+ 131.04566 124.4
[M+HCOO]- 193.04660 149.0
[M+CH3COO]- 207.06225 175.1
[M+Na-2H]- 169.02307 129.6
[M]+ 148.04785 124.2
[M]- 148.04895 124.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe