CID 9554235

Brn 2171738

Structural Information

Molecular Formula
C21H18N2O3
SMILES
C1=CC=C(C=C1)/C(=N\O)/C2=CC=C(C=C2)OCC(=O)NC3=CC=CC=C3
InChI
InChI=1S/C21H18N2O3/c24-20(22-18-9-5-2-6-10-18)15-26-19-13-11-17(12-14-19)21(23-25)16-7-3-1-4-8-16/h1-14,25H,15H2,(H,22,24)/b23-21+
InChIKey
UAAGVQRCBLFNMW-XTQSDGFTSA-N
Compound name
2-[4-[(E)-N-hydroxy-C-phenylcarbonimidoyl]phenoxy]-N-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

346.13174 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.13902 181.1
[M+Na]+ 369.12096 184.7
[M-H]- 345.12446 190.0
[M+NH4]+ 364.16556 192.2
[M+K]+ 385.09490 180.4
[M+H-H2O]+ 329.12900 170.7
[M+HCOO]- 391.12994 205.2
[M+CH3COO]- 405.14559 215.2
[M+Na-2H]- 367.10641 185.7
[M]+ 346.13119 180.1
[M]- 346.13229 180.1
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.