CID 688129

4-imidazolidinone, 1-benzoyl-2-(1,1-dimethylethyl)-3-methyl-, (2r)-

Structural Information

Molecular Formula
C15H20N2O2
SMILES
CC(C)(C)[C@@H]1N(C(=O)CN1C(=O)C2=CC=CC=C2)C
InChI
InChI=1S/C15H20N2O2/c1-15(2,3)14-16(4)12(18)10-17(14)13(19)11-8-6-5-7-9-11/h5-9,14H,10H2,1-4H3/t14-/m1/s1
InChIKey
QMSFVKQUCYMTLD-CQSZACIVSA-N
Compound name
(2R)-1-benzoyl-2-tert-butyl-3-methylimidazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

21
Patents

260.15247 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.159746 161.7
[M+Na]+ 283.141688 169.3
[M-H]- 259.145194 166.0
[M+NH4]+ 278.186293 178.0
[M+K]+ 299.115628 166.5
[M+H-H2O]+ 243.149730 154.4
[M+HCOO]- 305.150671 179.3
[M+CH3COO]- 319.166321 196.7
[M+Na-2H]- 281.127136 162.4
[M]+ 260.15192142 161.5
[M]- 260.15301858 161.5
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.