CID 3077549

Brn 4814137

Structural Information

Molecular Formula
C16H22N2O3
SMILES
CCCCCOC1=CC=C(C=C1)C2(C(=O)N(C(=O)N2)C)C
InChI
InChI=1S/C16H22N2O3/c1-4-5-6-11-21-13-9-7-12(8-10-13)16(2)14(19)18(3)15(20)17-16/h7-10H,4-6,11H2,1-3H3,(H,17,20)
InChIKey
NWDDUYCKTWIEQL-UHFFFAOYSA-N
Compound name
3,5-dimethyl-5-(4-pentoxyphenyl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.16306 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.17034 167.3
[M+Na]+ 313.15228 175.4
[M-H]- 289.15578 170.2
[M+NH4]+ 308.19688 183.7
[M+K]+ 329.12622 171.3
[M+H-H2O]+ 273.16032 159.9
[M+HCOO]- 335.16126 185.8
[M+CH3COO]- 349.17691 200.1
[M+Na-2H]- 311.13773 168.0
[M]+ 290.16251 169.0
[M]- 290.16361 169.0
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.