CID 4868399

5-(2,3-dihydro-1h-inden-5-yl)-5-methylimidazolidine-2,4-dione

Structural Information

Molecular Formula
C13H14N2O2
SMILES
CC1(C(=O)NC(=O)N1)C2=CC3=C(CCC3)C=C2
InChI
InChI=1S/C13H14N2O2/c1-13(11(16)14-12(17)15-13)10-6-5-8-3-2-4-9(8)7-10/h5-7H,2-4H2,1H3,(H2,14,15,16,17)
InChIKey
ROSLVZUWIGWQNX-UHFFFAOYSA-N
Compound name
5-(2,3-dihydro-1H-inden-5-yl)-5-methylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

230.10553 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.11281 152.4
[M+Na]+ 253.09475 161.0
[M-H]- 229.09825 155.2
[M+NH4]+ 248.13935 172.9
[M+K]+ 269.06869 155.7
[M+H-H2O]+ 213.10279 146.1
[M+HCOO]- 275.10373 169.4
[M+CH3COO]- 289.11938 164.0
[M+Na-2H]- 251.08020 153.7
[M]+ 230.10498 147.6
[M]- 230.10608 147.6
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