CID 17621

Hydantoin, 3-(4-(diethylamino)-2-butynyl)-5,5-diphenyl-, hydrochloride

Structural Information

Molecular Formula
C23H25N3O2
SMILES
CCN(CC)CC#CCN1C(=O)C(NC1=O)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C23H25N3O2/c1-3-25(4-2)17-11-12-18-26-21(27)23(24-22(26)28,19-13-7-5-8-14-19)20-15-9-6-10-16-20/h5-10,13-16H,3-4,17-18H2,1-2H3,(H,24,28)
InChIKey
MKQCZOPZDXSARS-UHFFFAOYSA-N
Compound name
3-[4-(diethylamino)but-2-ynyl]-5,5-diphenylimidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

375.19467 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 376.20195 194.0
[M+Na]+ 398.18389 201.9
[M-H]- 374.18739 197.1
[M+NH4]+ 393.22849 204.3
[M+K]+ 414.15783 192.7
[M+H-H2O]+ 358.19193 177.3
[M+HCOO]- 420.19287 206.9
[M+CH3COO]- 434.20852 223.0
[M+Na-2H]- 396.16934 192.0
[M]+ 375.19412 187.2
[M]- 375.19522 187.2
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.