CID 60534

2-imidazolinone, 1-(3-(dimethylamino)propyl)-5-phenyl-

Structural Information

Molecular Formula
C14H21N3O
SMILES
CN(C)CCCN1C(CNC1=O)C2=CC=CC=C2
InChI
InChI=1S/C14H21N3O/c1-16(2)9-6-10-17-13(11-15-14(17)18)12-7-4-3-5-8-12/h3-5,7-8,13H,6,9-11H2,1-2H3,(H,15,18)
InChIKey
QCEGPHPXLFTIPI-UHFFFAOYSA-N
Compound name
1-[3-(dimethylamino)propyl]-5-phenylimidazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

247.16846 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.175736 159.3
[M+Na]+ 270.157678 164.7
[M-H]- 246.161184 162.8
[M+NH4]+ 265.202283 175.3
[M+K]+ 286.131618 161.5
[M+H-H2O]+ 230.165720 150.5
[M+HCOO]- 292.166661 179.4
[M+CH3COO]- 306.182311 197.1
[M+Na-2H]- 268.143126 160.7
[M]+ 247.16791142 157.5
[M]- 247.16900858 157.5
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.