CID 263691

94485-93-5

Structural Information

Molecular Formula
C11H12N2O5
SMILES
C1CCC2(C1)C3(C2(C(=O)NC3=O)C(=O)O)C(=O)N
InChI
InChI=1S/C11H12N2O5/c12-5(14)10-6(15)13-7(16)11(10,8(17)18)9(10)3-1-2-4-9/h1-4H2,(H2,12,14)(H,17,18)(H,13,15,16)
InChIKey
PTDYRQXSLSDVQL-UHFFFAOYSA-N
Compound name
5-carbamoyl-2,4-dioxospiro[3-azabicyclo[3.1.0]hexane-6,1'-cyclopentane]-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

252.07462 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.08190 154.9
[M+Na]+ 275.06384 164.8
[M-H]- 251.06734 158.2
[M+NH4]+ 270.10844 173.9
[M+K]+ 291.03778 161.1
[M+H-H2O]+ 235.07188 154.0
[M+HCOO]- 297.07282 169.8
[M+CH3COO]- 311.08847 191.1
[M+Na-2H]- 273.04929 157.8
[M]+ 252.07407 154.8
[M]- 252.07517 154.8
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

No patent data available for this compound.