CID 123557392

2227204-75-1

Structural Information

Molecular Formula
C8H13NO2
SMILES
C1CC12CCNC(C2)C(=O)O
InChI
InChI=1S/C8H13NO2/c10-7(11)6-5-8(1-2-8)3-4-9-6/h6,9H,1-5H2,(H,10,11)
InChIKey
NBUCCWJVPXAUHG-UHFFFAOYSA-N
Compound name
6-azaspiro[2.5]octane-7-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

155.09464 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.10192 137.0
[M+Na]+ 178.08386 144.4
[M-H]- 154.08736 139.2
[M+NH4]+ 173.12846 152.5
[M+K]+ 194.05780 141.9
[M+H-H2O]+ 138.09190 131.6
[M+HCOO]- 200.09284 153.0
[M+CH3COO]- 214.10849 173.1
[M+Na-2H]- 176.06931 142.4
[M]+ 155.09409 133.2
[M]- 155.09519 133.2
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