CID 135438121

Cyclazodone

Structural Information

Molecular Formula
C12H12N2O2
SMILES
C1CC1N=C2NC(=O)C(O2)C3=CC=CC=C3
InChI
InChI=1S/C12H12N2O2/c15-11-10(8-4-2-1-3-5-8)16-12(14-11)13-9-6-7-9/h1-5,9-10H,6-7H2,(H,13,14,15)
InChIKey
DNRKTAYPGADPGW-UHFFFAOYSA-N
Compound name
2-cyclopropylimino-5-phenyl-1,3-oxazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

80
Patents

216.08987 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.09715 150.2
[M+Na]+ 239.07909 163.3
[M+NH4]+ 234.12369 158.7
[M+K]+ 255.05303 160.2
[M-H]- 215.08259 162.5
[M+Na-2H]- 237.06454 159.4
[M]+ 216.08932 156.5
[M]- 216.09042 156.5
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