CID 18442678

3-cyclopropylpyrrolidin-2-one

Structural Information

Molecular Formula
C7H11NO
SMILES
C1CC1C2CCNC2=O
InChI
InChI=1S/C7H11NO/c9-7-6(3-4-8-7)5-1-2-5/h5-6H,1-4H2,(H,8,9)
InChIKey
YJHIWTDVOURJEK-UHFFFAOYSA-N
Compound name
3-cyclopropylpyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

125.08406 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.091336 126.8
[M+Na]+ 148.073278 135.7
[M-H]- 124.076784 131.5
[M+NH4]+ 143.117883 143.8
[M+K]+ 164.047218 132.6
[M+H-H2O]+ 108.081320 120.6
[M+HCOO]- 170.082261 147.7
[M+CH3COO]- 184.097911 170.8
[M+Na-2H]- 146.058726 130.9
[M]+ 125.08351142 124.8
[M]- 125.08460858 124.8
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