CID 6869051

N'-[(e)-(2,3,4-trimethoxyphenyl)methylidene]pyridine-4-carbohydrazide

Structural Information

Molecular Formula
C16H17N3O4
SMILES
COC1=C(C(=C(C=C1)/C=N/NC(=O)C2=CC=NC=C2)OC)OC
InChI
InChI=1S/C16H17N3O4/c1-21-13-5-4-12(14(22-2)15(13)23-3)10-18-19-16(20)11-6-8-17-9-7-11/h4-10H,1-3H3,(H,19,20)/b18-10+
InChIKey
XHCGCAZUMZCBEU-VCHYOVAHSA-N
Compound name
N-[(E)-(2,3,4-trimethoxyphenyl)methylideneamino]pyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

315.12192 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.12920 171.5
[M+Na]+ 338.11114 178.6
[M-H]- 314.11464 178.6
[M+NH4]+ 333.15574 184.7
[M+K]+ 354.08508 176.7
[M+H-H2O]+ 298.11918 161.6
[M+HCOO]- 360.12012 197.6
[M+CH3COO]- 374.13577 212.9
[M+Na-2H]- 336.09659 176.7
[M]+ 315.12137 176.8
[M]- 315.12247 176.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.