CID 533688

17224-18-9

Structural Information

Molecular Formula
C19H21NO2
SMILES
CCCCOC1=CC=C(C=C1)C=NC2=CC=C(C=C2)C(=O)C
InChI
InChI=1S/C19H21NO2/c1-3-4-13-22-19-11-5-16(6-12-19)14-20-18-9-7-17(8-10-18)15(2)21/h5-12,14H,3-4,13H2,1-2H3
InChIKey
OCSNPDHAHJRADR-UHFFFAOYSA-N
Compound name
1-[4-[(4-butoxyphenyl)methylideneamino]phenyl]ethanone
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

41
Patents

295.15723 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.164506 171.1
[M+Na]+ 318.146448 177.2
[M-H]- 294.149954 178.7
[M+NH4]+ 313.191053 186.7
[M+K]+ 334.120388 173.4
[M+H-H2O]+ 278.154490 162.3
[M+HCOO]- 340.155431 196.1
[M+CH3COO]- 354.171081 209.3
[M+Na-2H]- 316.131896 174.6
[M]+ 295.15668142 174.6
[M]- 295.15777858 174.6
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