CID 50904505

1421365-63-0

Structural Information

Molecular Formula
C24H17ClN2O3
SMILES
COC1=CC=C(C=C1)OC2=C(C=NN(C2=O)C3C4=CC=CC=C4C5=CC=CC=C35)Cl
InChI
InChI=1S/C24H17ClN2O3/c1-29-15-10-12-16(13-11-15)30-23-21(25)14-26-27(24(23)28)22-19-8-4-2-6-17(19)18-7-3-5-9-20(18)22/h2-14,22H,1H3
InChIKey
QHVSQUYCVUHYKT-UHFFFAOYSA-N
Compound name
5-chloro-2-(9H-fluoren-9-yl)-4-(4-methoxyphenoxy)pyridazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

0
Patents

416.09277 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 417.10005 200.0
[M+Na]+ 439.08199 211.6
[M-H]- 415.08549 209.5
[M+NH4]+ 434.12659 211.9
[M+K]+ 455.05593 203.7
[M+H-H2O]+ 399.09003 188.8
[M+HCOO]- 461.09097 215.2
[M+CH3COO]- 475.10662 210.3
[M+Na-2H]- 437.06744 202.5
[M]+ 416.09222 206.7
[M]- 416.09332 206.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.