CID 94406

Benzenamine, 4-butyl-n-[(4-ethoxyphenyl)methylene]-

Structural Information

Molecular Formula
C19H23NO
SMILES
CCCCC1=CC=C(C=C1)N=CC2=CC=C(C=C2)OCC
InChI
InChI=1S/C19H23NO/c1-3-5-6-16-7-11-18(12-8-16)20-15-17-9-13-19(14-10-17)21-4-2/h7-15H,3-6H2,1-2H3
InChIKey
DBOAVDSSZWDGTH-UHFFFAOYSA-N
Compound name
N-(4-butylphenyl)-1-(4-ethoxyphenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

472
Patents

281.17798 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.18526 168.6
[M+Na]+ 304.16720 174.8
[M-H]- 280.17070 176.1
[M+NH4]+ 299.21180 185.0
[M+K]+ 320.14114 170.5
[M+H-H2O]+ 264.17524 159.9
[M+HCOO]- 326.17618 194.2
[M+CH3COO]- 340.19183 207.3
[M+Na-2H]- 302.15265 173.3
[M]+ 281.17743 172.0
[M]- 281.17853 172.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe