CID 4868347

2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetic acid

Structural Information

Molecular Formula
C11H16N2O4
SMILES
CC1CCC2(CC1)C(=O)N(C(=O)N2)CC(=O)O
InChI
InChI=1S/C11H16N2O4/c1-7-2-4-11(5-3-7)9(16)13(6-8(14)15)10(17)12-11/h7H,2-6H2,1H3,(H,12,17)(H,14,15)
InChIKey
JDHLGQPYECBZSL-UHFFFAOYSA-N
Compound name
2-(8-methyl-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

240.11101 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.118286 153.5
[M+Na]+ 263.100228 160.1
[M-H]- 239.103734 153.5
[M+NH4]+ 258.144833 171.0
[M+K]+ 279.074168 157.1
[M+H-H2O]+ 223.108270 147.6
[M+HCOO]- 285.109211 167.1
[M+CH3COO]- 299.124861 185.4
[M+Na-2H]- 261.085676 153.6
[M]+ 240.11046142 147.9
[M]- 240.11155858 147.9
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.