CID 119031263

5-amino-6-(oxolan-2-yl)piperidin-2-one

Structural Information

Molecular Formula
C9H16N2O2
SMILES
C1CC(OC1)C2C(CCC(=O)N2)N
InChI
InChI=1S/C9H16N2O2/c10-6-3-4-8(12)11-9(6)7-2-1-5-13-7/h6-7,9H,1-5,10H2,(H,11,12)
InChIKey
VBMUGBRTZPTDDH-UHFFFAOYSA-N
Compound name
5-amino-6-(oxolan-2-yl)piperidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.12119 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.128466 141.7
[M+Na]+ 207.110408 146.1
[M-H]- 183.113914 144.9
[M+NH4]+ 202.155013 159.0
[M+K]+ 223.084348 144.4
[M+H-H2O]+ 167.118450 134.9
[M+HCOO]- 229.119391 158.5
[M+CH3COO]- 243.135041 178.6
[M+Na-2H]- 205.095856 143.2
[M]+ 184.12064142 133.1
[M]- 184.12173858 133.1
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.