CID 9588230

4-pyridinecarboxaldehyde, 3-methyl-, o-ethyloxime, monohydrochloride

Structural Information

Molecular Formula
C9H12N2O
SMILES
CCO/N=C/C1=C(C=NC=C1)C
InChI
InChI=1S/C9H12N2O/c1-3-12-11-7-9-4-5-10-6-8(9)2/h4-7H,3H2,1-2H3/b11-7+
InChIKey
LDZZHCHKXKBPAO-YRNVUSSQSA-N
Compound name
(E)-N-ethoxy-1-(3-methyl-4-pyridinyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

164.09496 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.102236 133.6
[M+Na]+ 187.084178 141.9
[M-H]- 163.087684 137.4
[M+NH4]+ 182.128783 153.7
[M+K]+ 203.058118 140.7
[M+H-H2O]+ 147.092220 126.6
[M+HCOO]- 209.093161 159.9
[M+CH3COO]- 223.108811 183.0
[M+Na-2H]- 185.069626 142.1
[M]+ 164.09441142 136.2
[M]- 164.09550858 136.2
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.