CID 3055721

M.g. 18553

Structural Information

Molecular Formula
C11H16N2O6
SMILES
C1CC(=O)N(C1)CC(=O)N[C@@H](CCC(=O)O)C(=O)O
InChI
InChI=1S/C11H16N2O6/c14-8(6-13-5-1-2-9(13)15)12-7(11(18)19)3-4-10(16)17/h7H,1-6H2,(H,12,14)(H,16,17)(H,18,19)/t7-/m0/s1
InChIKey
WICFOVLHDGIFFM-ZETCQYMHSA-N
Compound name
(2S)-2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]pentanedioic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.10083 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.108106 159.6
[M+Na]+ 295.090048 162.6
[M-H]- 271.093554 158.3
[M+NH4]+ 290.134653 173.6
[M+K]+ 311.063988 162.1
[M+H-H2O]+ 255.098090 153.0
[M+HCOO]- 317.099031 176.0
[M+CH3COO]- 331.114681 194.3
[M+Na-2H]- 293.075496 157.0
[M]+ 272.10028142 157.6
[M]- 272.10137858 157.6
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.