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]+ 185.128466 144.1
[M+Na]+ 207.110408 148.3
[M-H]- 183.113914 141.8
[M+NH4]+ 202.155013 161.0
[M+K]+ 223.084348 144.4
[M+H-H2O]+ 167.118450 137.4
[M+HCOO]- 229.119391 154.8
[M+CH3COO]- 243.135041 171.3
[M+Na-2H]- 205.095856 148.2
[M]+ 184.12064142 132.0
[M]- 184.12173858 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.