CID 135439994

(e)-n'-(2-hydroxy-3-methoxybenzylidene)isonicotinohydrazide

Structural Information

Molecular Formula
C14H13N3O3
SMILES
COC1=CC=CC(=C1O)/C=N/NC(=O)C2=CC=NC=C2
InChI
InChI=1S/C14H13N3O3/c1-20-12-4-2-3-11(13(12)18)9-16-17-14(19)10-5-7-15-8-6-10/h2-9,18H,1H3,(H,17,19)/b16-9+
InChIKey
VWLOTRPSIVIFDW-CXUHLZMHSA-N
Compound name
N-[(E)-(2-hydroxy-3-methoxyphenyl)methylideneamino]pyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

5
Patents

271.0957 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.10298 159.7
[M+Na]+ 294.08492 166.6
[M-H]- 270.08842 165.4
[M+NH4]+ 289.12952 173.8
[M+K]+ 310.05886 163.5
[M+H-H2O]+ 254.09296 150.6
[M+HCOO]- 316.09390 184.9
[M+CH3COO]- 330.10955 201.1
[M+Na-2H]- 292.07037 166.2
[M]+ 271.09515 160.7
[M]- 271.09625 160.7
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

patents stripe