CID 207567

Hydantoin, 1-(3-phenylpropoxy)-

Structural Information

Molecular Formula
C12H14N2O3
SMILES
C1C(=O)NC(=O)N1OCCCC2=CC=CC=C2
InChI
InChI=1S/C12H14N2O3/c15-11-9-14(12(16)13-11)17-8-4-7-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2,(H,13,15,16)
InChIKey
HALANJNGSSKBQL-UHFFFAOYSA-N
Compound name
1-(3-phenylpropoxy)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

234.10045 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.107726 151.5
[M+Na]+ 257.089668 158.6
[M-H]- 233.093174 153.9
[M+NH4]+ 252.134273 167.4
[M+K]+ 273.063608 155.1
[M+H-H2O]+ 217.097710 143.3
[M+HCOO]- 279.098651 171.3
[M+CH3COO]- 293.114301 186.2
[M+Na-2H]- 255.075116 154.2
[M]+ 234.09990142 150.6
[M]- 234.10099858 150.6
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