CID 9649297

303085-23-6

Structural Information

Molecular Formula
C20H18N2O3
SMILES
CC(C(=O)N/N=C/C1=CC=CO1)OC2=CC=C(C=C2)C3=CC=CC=C3
InChI
InChI=1S/C20H18N2O3/c1-15(20(23)22-21-14-19-8-5-13-24-19)25-18-11-9-17(10-12-18)16-6-3-2-4-7-16/h2-15H,1H3,(H,22,23)/b21-14+
InChIKey
SQHSRSUPGINQLY-KGENOOAVSA-N
Compound name
N-[(E)-furan-2-ylmethylideneamino]-2-(4-phenylphenoxy)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

334.13174 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.139016 179.8
[M+Na]+ 357.120958 184.4
[M-H]- 333.124464 191.2
[M+NH4]+ 352.165563 192.9
[M+K]+ 373.094898 182.1
[M+H-H2O]+ 317.129000 170.3
[M+HCOO]- 379.129941 205.8
[M+CH3COO]- 393.145591 214.3
[M+Na-2H]- 355.106406 183.4
[M]+ 334.13119142 181.9
[M]- 334.13228858 181.9
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.