CID 231403

1-benzylimidazolidin-2-one

Structural Information

Molecular Formula
C10H12N2O
SMILES
C1CN(C(=O)N1)CC2=CC=CC=C2
InChI
InChI=1S/C10H12N2O/c13-10-11-6-7-12(10)8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,11,13)
InChIKey
IXNSPEIJKZNYLL-UHFFFAOYSA-N
Compound name
1-benzylimidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

252
Patents

176.09496 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.10224 139.3
[M+Na]+ 199.08418 151.2
[M+NH4]+ 194.12878 147.3
[M+K]+ 215.05812 146.5
[M-H]- 175.08768 141.3
[M+Na-2H]- 197.06963 146.0
[M]+ 176.09441 141.3
[M]- 176.09551 141.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe