CID 5390727

N'-(4-methoxybenzylidene)isonicotinohydrazide

Structural Information

Molecular Formula
C14H13N3O2
SMILES
COC1=CC=C(C=C1)/C=N/NC(=O)C2=CC=NC=C2
InChI
InChI=1S/C14H13N3O2/c1-19-13-4-2-11(3-5-13)10-16-17-14(18)12-6-8-15-9-7-12/h2-10H,1H3,(H,17,18)/b16-10+
InChIKey
MYEHAWYWNFNHPT-MHWRWJLKSA-N
Compound name
N-[(E)-(4-methoxyphenyl)methylideneamino]pyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

4
Patents

255.10077 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.10805 156.5
[M+Na]+ 278.08999 163.0
[M-H]- 254.09349 163.1
[M+NH4]+ 273.13459 171.7
[M+K]+ 294.06393 160.1
[M+H-H2O]+ 238.09803 147.1
[M+HCOO]- 300.09897 182.9
[M+CH3COO]- 314.11462 200.2
[M+Na-2H]- 276.07544 164.1
[M]+ 255.10022 157.5
[M]- 255.10132 157.5
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