CID 131750228

Moz-in-2

Structural Information

Molecular Formula
C17H13FN4O3S
SMILES
C1=CC=C(C=C1)S(=O)(=O)NNC(=O)C2=C(C=CC(=C2)C3=CN=NC=C3)F
InChI
InChI=1S/C17H13FN4O3S/c18-16-7-6-12(13-8-9-19-20-11-13)10-15(16)17(23)21-22-26(24,25)14-4-2-1-3-5-14/h1-11,22H,(H,21,23)
InChIKey
WYMCVPPNOFFNGE-UHFFFAOYSA-N
Compound name
N'-(benzenesulfonyl)-2-fluoro-5-pyridazin-4-ylbenzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2
Patents

372.06924 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.07652 179.5
[M+Na]+ 395.05846 191.6
[M+NH4]+ 390.10306 184.6
[M+K]+ 411.03240 184.2
[M-H]- 371.06196 182.7
[M+Na-2H]- 393.04391 189.3
[M]+ 372.06869 182.3
[M]- 372.06979 182.3
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

patents stripe