CID 3020625

1-hexylimidazolidine-2,4-dione

Structural Information

Molecular Formula
C9H16N2O2
SMILES
CCCCCCN1CC(=O)NC1=O
InChI
InChI=1S/C9H16N2O2/c1-2-3-4-5-6-11-7-8(12)10-9(11)13/h2-7H2,1H3,(H,10,12,13)
InChIKey
HFSWPCFMUVLFTM-UHFFFAOYSA-N
Compound name
1-hexylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

184.12119 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.128466 142.4
[M+Na]+ 207.110408 149.6
[M-H]- 183.113914 141.5
[M+NH4]+ 202.155013 160.9
[M+K]+ 223.084348 147.1
[M+H-H2O]+ 167.118450 135.7
[M+HCOO]- 229.119391 161.5
[M+CH3COO]- 243.135041 179.5
[M+Na-2H]- 205.095856 144.3
[M]+ 184.12064142 141.5
[M]- 184.12173858 141.5
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

patents stripe