CID 9568071

6-methyl-2-pyridinealdoxime o-benzyl ether

Structural Information

Molecular Formula
C14H14N2O
SMILES
CC1=NC(=CC=C1)/C=N/OCC2=CC=CC=C2
InChI
InChI=1S/C14H14N2O/c1-12-6-5-9-14(16-12)10-15-17-11-13-7-3-2-4-8-13/h2-10H,11H2,1H3/b15-10+
InChIKey
CISKZGJZNWBKSC-XNTDXEJSSA-N
Compound name
(E)-1-(6-methyl-2-pyridinyl)-N-phenylmethoxymethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.11061 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.117886 150.1
[M+Na]+ 249.099828 157.6
[M-H]- 225.103334 156.7
[M+NH4]+ 244.144433 167.1
[M+K]+ 265.073768 154.2
[M+H-H2O]+ 209.107870 141.2
[M+HCOO]- 271.108811 176.2
[M+CH3COO]- 285.124461 193.8
[M+Na-2H]- 247.085276 158.4
[M]+ 226.11006142 151.8
[M]- 226.11115858 151.8
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.