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]+ 317.128476 173.2
[M+Na]+ 339.110418 179.9
[M-H]- 315.113924 182.9
[M+NH4]+ 334.155023 186.4
[M+K]+ 355.084358 173.9
[M+H-H2O]+ 299.118460 163.3
[M+HCOO]- 361.119401 199.5
[M+CH3COO]- 375.135051 212.0
[M+Na-2H]- 337.095866 179.2
[M]+ 316.12065142 172.8
[M]- 316.12174858 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.