CID 122164336

7-oxa-2-azaspiro[3.5]nonane-1-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C8H13NO3
SMILES
C1COCCC12CNC2C(=O)O
InChI
InChI=1S/C8H13NO3/c10-7(11)6-8(5-9-6)1-3-12-4-2-8/h6,9H,1-5H2,(H,10,11)
InChIKey
LIMUTOGSLBPOFQ-UHFFFAOYSA-N
Compound name
7-oxa-2-azaspiro[3.5]nonane-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

171.08954 Da
Monoisotopic Mass

-2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.09682 138.3
[M+Na]+ 194.07876 142.7
[M+NH4]+ 189.12336 142.7
[M+K]+ 210.05270 139.3
[M-H]- 170.08226 136.7
[M+Na-2H]- 192.06421 139.8
[M]+ 171.08899 137.0
[M]- 171.09009 137.0
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