CID 9561246

4-pyridinealdoxime o-phenethyl ether

Structural Information

Molecular Formula
C14H14N2O
SMILES
C1=CC=C(C=C1)CCO/N=C/C2=CC=NC=C2
InChI
InChI=1S/C14H14N2O/c1-2-4-13(5-3-1)8-11-17-16-12-14-6-9-15-10-7-14/h1-7,9-10,12H,8,11H2/b16-12+
InChIKey
KSSSPNXPNSIVQI-FOWTUZBSSA-N
Compound name
(E)-N-(2-phenylethoxy)-1-pyridin-4-ylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.11061 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.117886 149.9
[M+Na]+ 249.099828 156.4
[M-H]- 225.103334 156.0
[M+NH4]+ 244.144433 166.6
[M+K]+ 265.073768 153.0
[M+H-H2O]+ 209.107870 140.8
[M+HCOO]- 271.108811 176.0
[M+CH3COO]- 285.124461 192.7
[M+Na-2H]- 247.085276 159.0
[M]+ 226.11006142 151.2
[M]- 226.11115858 151.2
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.