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]+ 227.11789 149.9
[M+Na]+ 249.09983 156.4
[M-H]- 225.10333 156.0
[M+NH4]+ 244.14443 166.6
[M+K]+ 265.07377 153.0
[M+H-H2O]+ 209.10787 140.8
[M+HCOO]- 271.10881 176.0
[M+CH3COO]- 285.12446 192.7
[M+Na-2H]- 247.08528 159.0
[M]+ 226.11006 151.2
[M]- 226.11116 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.