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]+ 248.17574 159.3
[M+Na]+ 270.15768 164.7
[M-H]- 246.16118 162.8
[M+NH4]+ 265.20228 175.3
[M+K]+ 286.13162 161.5
[M+H-H2O]+ 230.16572 150.5
[M+HCOO]- 292.16666 179.4
[M+CH3COO]- 306.18231 197.1
[M+Na-2H]- 268.14313 160.7
[M]+ 247.16791 157.5
[M]- 247.16901 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.