CID 57377

3-(morpholinomethyl)-5-(p-isobutoxyphenyl)-5-methylhydantoin hydrochloride

Structural Information

Molecular Formula
C19H27N3O4
SMILES
CC(C)COC1=CC=C(C=C1)C2(C(=O)N(C(=O)N2)CN3CCOCC3)C
InChI
InChI=1S/C19H27N3O4/c1-14(2)12-26-16-6-4-15(5-7-16)19(3)17(23)22(18(24)20-19)13-21-8-10-25-11-9-21/h4-7,14H,8-13H2,1-3H3,(H,20,24)
InChIKey
QEGOYUIFSKYDCR-UHFFFAOYSA-N
Compound name
5-methyl-5-[4-(2-methylpropoxy)phenyl]-3-(morpholin-4-ylmethyl)imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

361.20016 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 362.20744 187.2
[M+Na]+ 384.18938 191.8
[M-H]- 360.19288 191.4
[M+NH4]+ 379.23398 196.9
[M+K]+ 400.16332 189.0
[M+H-H2O]+ 344.19742 177.4
[M+HCOO]- 406.19836 198.5
[M+CH3COO]- 420.21401 212.3
[M+Na-2H]- 382.17483 184.8
[M]+ 361.19961 184.9
[M]- 361.20071 184.9
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.