CID 3162834

2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetic acid

Structural Information

Molecular Formula
C10H14N2O4
SMILES
C1CCC2(CC1)C(=O)N(C(=O)N2)CC(=O)O
InChI
InChI=1S/C10H14N2O4/c13-7(14)6-12-8(15)10(11-9(12)16)4-2-1-3-5-10/h1-6H2,(H,11,16)(H,13,14)
InChIKey
CGXTWPOZGXKGOX-UHFFFAOYSA-N
Compound name
2-(2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.09535 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.10263 149.8
[M+Na]+ 249.08457 155.8
[M-H]- 225.08807 149.6
[M+NH4]+ 244.12917 167.5
[M+K]+ 265.05851 153.0
[M+H-H2O]+ 209.09261 143.6
[M+HCOO]- 271.09355 163.7
[M+CH3COO]- 285.10920 181.1
[M+Na-2H]- 247.07002 150.9
[M]+ 226.09480 143.3
[M]- 226.09590 143.3
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.