CID 9607182

329777-95-9

Structural Information

Molecular Formula
C22H20FN3O2
SMILES
C1=CC=C(C=C1)NCC(=O)N/N=C/C2=CC=C(C=C2)OCC3=CC=C(C=C3)F
InChI
InChI=1S/C22H20FN3O2/c23-19-10-6-18(7-11-19)16-28-21-12-8-17(9-13-21)14-25-26-22(27)15-24-20-4-2-1-3-5-20/h1-14,24H,15-16H2,(H,26,27)/b25-14+
InChIKey
MFAJCVBPQSRYLM-AFUMVMLFSA-N
Compound name
2-anilino-N-[(E)-[4-[(4-fluorophenyl)methoxy]phenyl]methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

377.15396 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 378.16124 188.4
[M+Na]+ 400.14318 192.6
[M-H]- 376.14668 197.3
[M+NH4]+ 395.18778 199.1
[M+K]+ 416.11712 187.2
[M+H-H2O]+ 360.15122 176.4
[M+HCOO]- 422.15216 214.5
[M+CH3COO]- 436.16781 226.4
[M+Na-2H]- 398.12863 193.3
[M]+ 377.15341 187.6
[M]- 377.15451 187.6
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.