CID 138990985

2309446-36-2

Structural Information

Molecular Formula
C8H13NO2
SMILES
C1C(CC12CNC2)CC(=O)O
InChI
InChI=1S/C8H13NO2/c10-7(11)1-6-2-8(3-6)4-9-5-8/h6,9H,1-5H2,(H,10,11)
InChIKey
WWIYMGMCVWCWTO-UHFFFAOYSA-N
Compound name
2-(2-azaspiro[3.3]heptan-6-yl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.09464 Da
Monoisotopic Mass

-2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.10192 130.8
[M+Na]+ 178.08386 134.2
[M-H]- 154.08736 132.3
[M+NH4]+ 173.12846 137.8
[M+K]+ 194.05780 138.0
[M+H-H2O]+ 138.09190 117.3
[M+HCOO]- 200.09284 145.1
[M+CH3COO]- 214.10849 184.3
[M+Na-2H]- 176.06931 135.3
[M]+ 155.09409 143.1
[M]- 155.09519 143.1
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.