CID 40424582

N-(4-ethoxybenzylidene)-4-acetylaniline

Structural Information

Molecular Formula
C17H17NO2
SMILES
CCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C(=O)C
InChI
InChI=1S/C17H17NO2/c1-3-20-17-10-4-14(5-11-17)12-18-16-8-6-15(7-9-16)13(2)19/h4-12H,3H2,1-2H3
InChIKey
HCDYNBNSFSMUIM-UHFFFAOYSA-N
Compound name
1-[4-[(4-ethoxyphenyl)methylideneamino]phenyl]ethanone
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

27
Patents

267.12592 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.13320 161.8
[M+Na]+ 290.11514 168.8
[M-H]- 266.11864 169.8
[M+NH4]+ 285.15974 178.5
[M+K]+ 306.08908 165.5
[M+H-H2O]+ 250.12318 153.4
[M+HCOO]- 312.12412 187.5
[M+CH3COO]- 326.13977 203.4
[M+Na-2H]- 288.10059 166.4
[M]+ 267.12537 164.6
[M]- 267.12647 164.6
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

patents stripe