CID 439269

(s)-ureidoglycolate

Structural Information

Molecular Formula
C3H6N2O4
SMILES
[C@H](C(=O)O)(NC(=O)N)O
InChI
InChI=1S/C3H6N2O4/c4-3(9)5-1(6)2(7)8/h1,6H,(H,7,8)(H3,4,5,9)/t1-/m0/s1
InChIKey
NWZYYCVIOKVTII-SFOWXEAESA-N
Compound name
(2S)-2-(carbamoylamino)-2-hydroxyacetic acid
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

4
References

72
Patents

134.03276 Da
Monoisotopic Mass

-2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.04004 124.4
[M+Na]+ 157.02198 130.0
[M-H]- 133.02548 121.8
[M+NH4]+ 152.06658 143.4
[M+K]+ 172.99592 130.5
[M+H-H2O]+ 117.03002 119.3
[M+HCOO]- 179.03096 145.8
[M+CH3COO]- 193.04661 170.8
[M+Na-2H]- 155.00743 127.3
[M]+ 134.03221 120.2
[M]- 134.03331 120.2
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.