CID 83686105

2287301-02-2

Structural Information

Molecular Formula
C10H15NO3
SMILES
C1CC2(CCC1C(=O)O)CC(=O)NC2
InChI
InChI=1S/C10H15NO3/c12-8-5-10(6-11-8)3-1-7(2-4-10)9(13)14/h7H,1-6H2,(H,11,12)(H,13,14)
InChIKey
KWVRHHUTOFVGRN-UHFFFAOYSA-N
Compound name
3-oxo-2-azaspiro[4.5]decane-8-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.1052 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.11248 144.9
[M+Na]+ 220.09442 149.9
[M-H]- 196.09792 145.8
[M+NH4]+ 215.13902 165.1
[M+K]+ 236.06836 147.1
[M+H-H2O]+ 180.10246 139.5
[M+HCOO]- 242.10340 159.8
[M+CH3COO]- 256.11905 175.6
[M+Na-2H]- 218.07987 146.5
[M]+ 197.10465 136.7
[M]- 197.10575 136.7
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.