CID 3058417

3,4-diethoxy-n-(4-pyridinylmethylene)benzenamine monohydrochloride

Structural Information

Molecular Formula
C16H18N2O2
SMILES
CCOC1=C(C=C(C=C1)N=CC2=CC=NC=C2)OCC
InChI
InChI=1S/C16H18N2O2/c1-3-19-15-6-5-14(11-16(15)20-4-2)18-12-13-7-9-17-10-8-13/h5-12H,3-4H2,1-2H3
InChIKey
XXXUKZCWLJYOOY-UHFFFAOYSA-N
Compound name
N-(3,4-diethoxyphenyl)-1-pyridin-4-ylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

270.13684 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.14412 163.5
[M+Na]+ 293.12606 178.0
[M+NH4]+ 288.17066 171.4
[M+K]+ 309.10000 169.4
[M-H]- 269.12956 168.3
[M+Na-2H]- 291.11151 173.1
[M]+ 270.13629 167.0
[M]- 270.13739 167.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.