CID 22990583

4-cyclobutylpyrrolidin-2-one

Structural Information

Molecular Formula
C8H13NO
SMILES
C1CC(C1)C2CC(=O)NC2
InChI
InChI=1S/C8H13NO/c10-8-4-7(5-9-8)6-2-1-3-6/h6-7H,1-5H2,(H,9,10)
InChIKey
CVRJEQBETQXNIG-UHFFFAOYSA-N
Compound name
4-cyclobutylpyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

139.09972 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.10700 125.8
[M+Na]+ 162.08894 130.5
[M-H]- 138.09244 129.3
[M+NH4]+ 157.13354 140.5
[M+K]+ 178.06288 131.4
[M+H-H2O]+ 122.09698 115.1
[M+HCOO]- 184.09792 144.5
[M+CH3COO]- 198.11357 173.3
[M+Na-2H]- 160.07439 128.9
[M]+ 139.09917 128.8
[M]- 139.10027 128.8
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

patents stripe