CID 40488778

N-(3-chlorophenyl)-n'-(3-hydroxy-2-pyridinyl)urea

Structural Information

Molecular Formula
C12H10ClN3O2
SMILES
C1=CC(=CC(=C1)Cl)NC(=O)NC2=C(C=CC=N2)O
InChI
InChI=1S/C12H10ClN3O2/c13-8-3-1-4-9(7-8)15-12(18)16-11-10(17)5-2-6-14-11/h1-7,17H,(H2,14,15,16,18)
InChIKey
LBFVVHJHSZCHBK-UHFFFAOYSA-N
Compound name
1-(3-chlorophenyl)-3-(3-hydroxypyridin-2-yl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

263.04614 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.05342 155.3
[M+Na]+ 286.03536 163.3
[M-H]- 262.03886 159.8
[M+NH4]+ 281.07996 170.2
[M+K]+ 302.00930 158.0
[M+H-H2O]+ 246.04340 148.0
[M+HCOO]- 308.04434 174.8
[M+CH3COO]- 322.05999 195.0
[M+Na-2H]- 284.02081 161.8
[M]+ 263.04559 155.4
[M]- 263.04669 155.4
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

patents stripe