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]+ 227.13902 153.3
[M+Na]+ 249.12096 159.4
[M-H]- 225.12446 152.4
[M+NH4]+ 244.16556 169.9
[M+K]+ 265.09490 157.3
[M+H-H2O]+ 209.12900 146.5
[M+HCOO]- 271.12994 170.1
[M+CH3COO]- 285.14559 187.8
[M+Na-2H]- 247.10641 151.9
[M]+ 226.13119 152.5
[M]- 226.13229 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.