CID 43314756

5-[4-(aminomethyl)phenyl]-5-methylimidazolidine-2,4-dione hydrochloride

Structural Information

Molecular Formula
C11H13N3O2
SMILES
CC1(C(=O)NC(=O)N1)C2=CC=C(C=C2)CN
InChI
InChI=1S/C11H13N3O2/c1-11(9(15)13-10(16)14-11)8-4-2-7(6-12)3-5-8/h2-5H,6,12H2,1H3,(H2,13,14,15,16)
InChIKey
JXMYWTKMMOEYIW-UHFFFAOYSA-N
Compound name
5-[4-(aminomethyl)phenyl]-5-methylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

219.10077 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.10805 148.1
[M+Na]+ 242.08999 156.4
[M-H]- 218.09349 149.6
[M+NH4]+ 237.13459 165.8
[M+K]+ 258.06393 151.5
[M+H-H2O]+ 202.09803 141.4
[M+HCOO]- 264.09897 167.0
[M+CH3COO]- 278.11462 183.9
[M+Na-2H]- 240.07544 150.9
[M]+ 219.10022 142.7
[M]- 219.10132 142.7
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