CID 3063773

Hydantoin, 1-(2-propylvaleryl)-

Structural Information

Molecular Formula
C11H18N2O3
SMILES
CCCC(CCC)C(=O)N1CC(=O)NC1=O
InChI
InChI=1S/C11H18N2O3/c1-3-5-8(6-4-2)10(15)13-7-9(14)12-11(13)16/h8H,3-7H2,1-2H3,(H,12,14,16)
InChIKey
QMIKQDZKBPDEAU-UHFFFAOYSA-N
Compound name
1-(2-propylpentanoyl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.13174 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.139016 153.3
[M+Na]+ 249.120958 159.4
[M-H]- 225.124464 152.4
[M+NH4]+ 244.165563 169.9
[M+K]+ 265.094898 157.3
[M+H-H2O]+ 209.129000 146.5
[M+HCOO]- 271.129941 170.1
[M+CH3COO]- 285.145591 187.8
[M+Na-2H]- 247.106406 151.9
[M]+ 226.13119142 152.5
[M]- 226.13228858 152.5
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.