CID 126824791

4-hydroxy-2,9-diazaspiro[5.5]undecan-1-one hydrochloride

Structural Information

Molecular Formula
C9H16N2O2
SMILES
C1CNCCC12CC(CNC2=O)O
InChI
InChI=1S/C9H16N2O2/c12-7-5-9(8(13)11-6-7)1-3-10-4-2-9/h7,10,12H,1-6H2,(H,11,13)
InChIKey
PGLKLRYVJYKCEP-UHFFFAOYSA-N
Compound name
4-hydroxy-2,9-diazaspiro[5.5]undecan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.12119 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.12847 144.1
[M+Na]+ 207.11041 148.3
[M-H]- 183.11391 141.8
[M+NH4]+ 202.15501 161.0
[M+K]+ 223.08435 144.4
[M+H-H2O]+ 167.11845 137.4
[M+HCOO]- 229.11939 154.8
[M+CH3COO]- 243.13504 171.3
[M+Na-2H]- 205.09586 148.2
[M]+ 184.12064 132.0
[M]- 184.12174 132.0
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

No patent data available for this compound.