CID 9630472

N-(2-(2-(9-anthrylmethylene)hydrazino)-2-oxoethyl)-4-fluorobenzamide

Structural Information

Molecular Formula
C24H18FN3O2
SMILES
C1=CC=C2C(=C1)C=C3C=CC=CC3=C2/C=N/NC(=O)CNC(=O)C4=CC=C(C=C4)F
InChI
InChI=1S/C24H18FN3O2/c25-19-11-9-16(10-12-19)24(30)26-15-23(29)28-27-14-22-20-7-3-1-5-17(20)13-18-6-2-4-8-21(18)22/h1-14H,15H2,(H,26,30)(H,28,29)/b27-14+
InChIKey
ZLZGCFOXCJATME-MZJWZYIUSA-N
Compound name
N-[2-[(2E)-2-(anthracen-9-ylmethylidene)hydrazinyl]-2-oxoethyl]-4-fluorobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

399.1383 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 400.14558 192.3
[M+Na]+ 422.12752 198.7
[M-H]- 398.13102 200.3
[M+NH4]+ 417.17212 204.3
[M+K]+ 438.10146 192.5
[M+H-H2O]+ 382.13556 180.8
[M+HCOO]- 444.13650 216.1
[M+CH3COO]- 458.15215 201.7
[M+Na-2H]- 420.11297 199.2
[M]+ 399.13775 192.7
[M]- 399.13885 192.7
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.