CID 165657428

4-(1-methylcyclopropyl)pyrrolidin-2-one

Structural Information

Molecular Formula
C8H13NO
SMILES
CC1(CC1)C2CC(=O)NC2
InChI
InChI=1S/C8H13NO/c1-8(2-3-8)6-4-7(10)9-5-6/h6H,2-5H2,1H3,(H,9,10)
InChIKey
MDZBYZLRFREROU-UHFFFAOYSA-N
Compound name
4-(1-methylcyclopropyl)pyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

139.09972 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.106996 131.3
[M+Na]+ 162.088938 140.5
[M-H]- 138.092444 136.3
[M+NH4]+ 157.133543 149.7
[M+K]+ 178.062878 138.0
[M+H-H2O]+ 122.096980 126.1
[M+HCOO]- 184.097921 151.6
[M+CH3COO]- 198.113571 173.3
[M+Na-2H]- 160.074386 136.0
[M]+ 139.09917142 130.1
[M]- 139.10026858 130.1
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.