CID 1550957

(5s)-5-[(1h-indol-3-yl)methyl]imidazolidine-2,4-dione

Structural Information

Molecular Formula
C12H11N3O2
SMILES
C1=CC=C2C(=C1)C(=CN2)C[C@H]3C(=O)NC(=O)N3
InChI
InChI=1S/C12H11N3O2/c16-11-10(14-12(17)15-11)5-7-6-13-9-4-2-1-3-8(7)9/h1-4,6,10,13H,5H2,(H2,14,15,16,17)/t10-/m0/s1
InChIKey
RUUREKIGAKIKIL-JTQLQIEISA-N
Compound name
(5S)-5-(1H-indol-3-ylmethyl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

229.08513 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.09241 150.2
[M+Na]+ 252.07435 159.7
[M-H]- 228.07785 150.9
[M+NH4]+ 247.11895 166.8
[M+K]+ 268.04829 153.3
[M+H-H2O]+ 212.08239 142.9
[M+HCOO]- 274.08333 167.6
[M+CH3COO]- 288.09898 161.4
[M+Na-2H]- 250.05980 152.2
[M]+ 229.08458 146.4
[M]- 229.08568 146.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.