CID 145905713

2-(hydroxymethyl)-6-azaspiro[3.4]octan-7-one

Structural Information

Molecular Formula
C8H13NO2
SMILES
C1C(CC12CC(=O)NC2)CO
InChI
InChI=1S/C8H13NO2/c10-4-6-1-8(2-6)3-7(11)9-5-8/h6,10H,1-5H2,(H,9,11)
InChIKey
WDOSMTYTRCZDKM-UHFFFAOYSA-N
Compound name
2-(hydroxymethyl)-6-azaspiro[3.4]octan-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

155.09464 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.101916 131.0
[M+Na]+ 178.083858 136.7
[M-H]- 154.087364 132.7
[M+NH4]+ 173.128463 146.9
[M+K]+ 194.057798 136.9
[M+H-H2O]+ 138.091900 121.8
[M+HCOO]- 200.092841 148.3
[M+CH3COO]- 214.108491 172.6
[M+Na-2H]- 176.069306 135.1
[M]+ 155.09409142 134.7
[M]- 155.09518858 134.7
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.