CID 3074941

N-benzhydryl-n'-(2-furoyl)urea

Structural Information

Molecular Formula
C19H16N2O3
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)NC(=O)C3=CC=CO3
InChI
InChI=1S/C19H16N2O3/c22-18(16-12-7-13-24-16)21-19(23)20-17(14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-13,17H,(H2,20,21,22,23)
InChIKey
HVZMVJUPOOYSFL-UHFFFAOYSA-N
Compound name
N-(benzhydrylcarbamoyl)furan-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

320.1161 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 321.123376 175.4
[M+Na]+ 343.105318 178.9
[M-H]- 319.108824 185.5
[M+NH4]+ 338.149923 188.1
[M+K]+ 359.079258 176.6
[M+H-H2O]+ 303.113360 166.4
[M+HCOO]- 365.114301 199.3
[M+CH3COO]- 379.129951 208.1
[M+Na-2H]- 341.090766 178.7
[M]+ 320.11555142 174.4
[M]- 320.11664858 174.4
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

No patent data available for this compound.