CID 3025280

Urea, (2-(2,6-dichlorophenoxy)ethyl)-

Structural Information

Molecular Formula
C9H10Cl2N2O2
SMILES
C1=CC(=C(C(=C1)Cl)OCCNC(=O)N)Cl
InChI
InChI=1S/C9H10Cl2N2O2/c10-6-2-1-3-7(11)8(6)15-5-4-13-9(12)14/h1-3H,4-5H2,(H3,12,13,14)
InChIKey
DNGGVVZOBSEDOT-UHFFFAOYSA-N
Compound name
2-(2,6-dichlorophenoxy)ethylurea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.01193 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.01921 150.4
[M+Na]+ 271.00115 159.0
[M-H]- 247.00465 153.2
[M+NH4]+ 266.04575 168.4
[M+K]+ 286.97509 154.1
[M+H-H2O]+ 231.00919 146.0
[M+HCOO]- 293.01013 166.4
[M+CH3COO]- 307.02578 194.6
[M+Na-2H]- 268.98660 154.1
[M]+ 248.01138 153.1
[M]- 248.01248 153.1
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.