CID 122151364

2-azaspiro[3.4]octane-1-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C8H13NO2
SMILES
C1CCC2(C1)CNC2C(=O)O
InChI
InChI=1S/C8H13NO2/c10-7(11)6-8(5-9-6)3-1-2-4-8/h6,9H,1-5H2,(H,10,11)
InChIKey
KPSWSDNHHBJSLK-UHFFFAOYSA-N
Compound name
2-azaspiro[3.4]octane-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.09464 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.101916 133.1
[M+Na]+ 178.083858 137.6
[M-H]- 154.087364 134.5
[M+NH4]+ 173.128463 148.6
[M+K]+ 194.057798 138.3
[M+H-H2O]+ 138.091900 123.6
[M+HCOO]- 200.092841 149.4
[M+CH3COO]- 214.108491 172.4
[M+Na-2H]- 176.069306 136.5
[M]+ 155.09409142 135.7
[M]- 155.09518858 135.7
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.