CID 132388280

5-oxa-2-azaspiro[3.4]octane-7-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C7H11NO3
SMILES
C1C(COC12CNC2)C(=O)O
InChI
InChI=1S/C7H11NO3/c9-6(10)5-1-7(11-2-5)3-8-4-7/h5,8H,1-4H2,(H,9,10)
InChIKey
SYYWGSGPWFJYEG-UHFFFAOYSA-N
Compound name
5-oxa-2-azaspiro[3.4]octane-7-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.0739 Da
Monoisotopic Mass

-3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.081176 128.6
[M+Na]+ 180.063118 133.2
[M-H]- 156.066624 130.6
[M+NH4]+ 175.107723 142.6
[M+K]+ 196.037058 135.7
[M+H-H2O]+ 140.071160 119.2
[M+HCOO]- 202.072101 144.4
[M+CH3COO]- 216.087751 171.5
[M+Na-2H]- 178.048566 133.6
[M]+ 157.07335142 132.8
[M]- 157.07444858 132.8
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.