CID 4290485

N-(2-formylamino-(1,1',4',1'')terphenyl-2''-yl)-formamide

Structural Information

Molecular Formula
C20H16N2O2
SMILES
C1=CC=C(C(=C1)C2=CC=C(C=C2)C3=CC=CC=C3NC=O)NC=O
InChI
InChI=1S/C20H16N2O2/c23-13-21-19-7-3-1-5-17(19)15-9-11-16(12-10-15)18-6-2-4-8-20(18)22-14-24/h1-14H,(H,21,23)(H,22,24)
InChIKey
HDLRCMROLVGHFY-UHFFFAOYSA-N
Compound name
N-[2-[4-(2-formamidophenyl)phenyl]phenyl]formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

316.1212 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.12848 173.2
[M+Na]+ 339.11042 179.9
[M-H]- 315.11392 182.9
[M+NH4]+ 334.15502 186.4
[M+K]+ 355.08436 173.9
[M+H-H2O]+ 299.11846 163.3
[M+HCOO]- 361.11940 199.5
[M+CH3COO]- 375.13505 212.0
[M+Na-2H]- 337.09587 179.2
[M]+ 316.12065 172.8
[M]- 316.12175 172.8
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.