CID 3060902

78371-89-8

Structural Information

Molecular Formula
C19H24ClN3O
SMILES
CCN(CC)CCN(C1=CC=CC=C1)C(=O)NC2=CC=CC=C2Cl
InChI
InChI=1S/C19H24ClN3O/c1-3-22(4-2)14-15-23(16-10-6-5-7-11-16)19(24)21-18-13-9-8-12-17(18)20/h5-13H,3-4,14-15H2,1-2H3,(H,21,24)
InChIKey
FMENEMNSPDKSQF-UHFFFAOYSA-N
Compound name
3-(2-chlorophenyl)-1-[2-(diethylamino)ethyl]-1-phenylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

345.1608 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 346.16808 185.5
[M+Na]+ 368.15002 189.4
[M-H]- 344.15352 193.8
[M+NH4]+ 363.19462 199.6
[M+K]+ 384.12396 185.7
[M+H-H2O]+ 328.15806 176.6
[M+HCOO]- 390.15900 207.1
[M+CH3COO]- 404.17465 224.0
[M+Na-2H]- 366.13547 187.9
[M]+ 345.16025 189.5
[M]- 345.16135 189.5
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.