CID 3073650

Acetamide, n-(4-((5-(phenylamino)-1,3,4-oxadiazol-2-yl)methoxy)phenyl)-

Structural Information

Molecular Formula
C17H16N4O3
SMILES
CC(=O)NC1=CC=C(C=C1)OCC2=NN=C(O2)NC3=CC=CC=C3
InChI
InChI=1S/C17H16N4O3/c1-12(22)18-14-7-9-15(10-8-14)23-11-16-20-21-17(24-16)19-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,18,22)(H,19,21)
InChIKey
NLDOFCLGEQZBNJ-UHFFFAOYSA-N
Compound name
N-[4-[(5-anilino-1,3,4-oxadiazol-2-yl)methoxy]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.12225 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.12953 173.3
[M+Na]+ 347.11147 179.6
[M-H]- 323.11497 181.5
[M+NH4]+ 342.15607 183.9
[M+K]+ 363.08541 176.8
[M+H-H2O]+ 307.11951 162.7
[M+HCOO]- 369.12045 197.1
[M+CH3COO]- 383.13610 210.2
[M+Na-2H]- 345.09692 178.8
[M]+ 324.12170 175.4
[M]- 324.12280 175.5
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.