CID 467641

N'-[(3-fluorophenyl)methyl]pyridine-4-carbohydrazide

Structural Information

Molecular Formula
C13H12FN3O
SMILES
C1=CC(=CC(=C1)F)CNNC(=O)C2=CC=NC=C2
InChI
InChI=1S/C13H12FN3O/c14-12-3-1-2-10(8-12)9-16-17-13(18)11-4-6-15-7-5-11/h1-8,16H,9H2,(H,17,18)
InChIKey
CMSALYZLAVTLCL-UHFFFAOYSA-N
Compound name
N'-[(3-fluorophenyl)methyl]pyridine-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

245.09644 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.10372 152.3
[M+Na]+ 268.08566 158.7
[M-H]- 244.08916 156.3
[M+NH4]+ 263.13026 167.3
[M+K]+ 284.05960 154.6
[M+H-H2O]+ 228.09370 142.6
[M+HCOO]- 290.09464 176.2
[M+CH3COO]- 304.11029 196.7
[M+Na-2H]- 266.07111 159.4
[M]+ 245.09589 149.5
[M]- 245.09699 149.5
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