CID 688285

Di-2-pyridyl ketone benzoylhydrazone

Structural Information

Molecular Formula
C18H14N4O
SMILES
C1=CC=C(C=C1)C(=O)NN=C(C2=CC=CC=N2)C3=CC=CC=N3
InChI
InChI=1S/C18H14N4O/c23-18(14-8-2-1-3-9-14)22-21-17(15-10-4-6-12-19-15)16-11-5-7-13-20-16/h1-13H,(H,22,23)
InChIKey
JKDNNYIZVUOWOE-UHFFFAOYSA-N
Compound name
N-(dipyridin-2-ylmethylideneamino)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

21
Patents

302.11676 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.12404 169.2
[M+Na]+ 325.10598 174.0
[M-H]- 301.10948 176.9
[M+NH4]+ 320.15058 180.0
[M+K]+ 341.07992 169.0
[M+H-H2O]+ 285.11402 157.6
[M+HCOO]- 347.11496 192.9
[M+CH3COO]- 361.13061 179.4
[M+Na-2H]- 323.09143 177.2
[M]+ 302.11621 167.0
[M]- 302.11731 167.0
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