CID 51342230

6-azaspiro[2.5]octane-1-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C8H13NO2
SMILES
C1CNCCC12CC2C(=O)O
InChI
InChI=1S/C8H13NO2/c10-7(11)6-5-8(6)1-3-9-4-2-8/h6,9H,1-5H2,(H,10,11)
InChIKey
IGWUPWROVTYRES-UHFFFAOYSA-N
Compound name
6-azaspiro[2.5]octane-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

155.09464 Da
Monoisotopic Mass

-2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.10192 137.4
[M+Na]+ 178.08386 148.3
[M+NH4]+ 173.12846 147.1
[M+K]+ 194.05780 143.2
[M-H]- 154.08736 144.9
[M+Na-2H]- 176.06931 145.1
[M]+ 155.09409 142.0
[M]- 155.09519 142.0
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

patents stripe