CID 240167

6341-37-3

Structural Information

Molecular Formula
C18H22N2O2
SMILES
CC1=C(C=C(C=C1)C(C)C)NC(=O)NC2=CC=CC=C2OC
InChI
InChI=1S/C18H22N2O2/c1-12(2)14-10-9-13(3)16(11-14)20-18(21)19-15-7-5-6-8-17(15)22-4/h5-12H,1-4H3,(H2,19,20,21)
InChIKey
YIOZSFNDGMKRKF-UHFFFAOYSA-N
Compound name
1-(2-methoxyphenyl)-3-(2-methyl-5-propan-2-ylphenyl)urea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

298.16812 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.17540 172.4
[M+Na]+ 321.15734 178.0
[M-H]- 297.16084 179.2
[M+NH4]+ 316.20194 187.2
[M+K]+ 337.13128 174.9
[M+H-H2O]+ 281.16538 164.0
[M+HCOO]- 343.16632 196.1
[M+CH3COO]- 357.18197 211.2
[M+Na-2H]- 319.14279 174.4
[M]+ 298.16757 173.4
[M]- 298.16867 173.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.