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]+ 321.12338 175.4
[M+Na]+ 343.10532 178.9
[M-H]- 319.10882 185.5
[M+NH4]+ 338.14992 188.1
[M+K]+ 359.07926 176.6
[M+H-H2O]+ 303.11336 166.4
[M+HCOO]- 365.11430 199.3
[M+CH3COO]- 379.12995 208.1
[M+Na-2H]- 341.09077 178.7
[M]+ 320.11555 174.4
[M]- 320.11665 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.