CID 3085702

Benzenamine, 4,4'-methylenebis(n-butylidene-

Structural Information

Molecular Formula
C21H26N2
SMILES
CCCC=NC1=CC=C(C=C1)CC2=CC=C(C=C2)N=CCCC
InChI
InChI=1S/C21H26N2/c1-3-5-15-22-20-11-7-18(8-12-20)17-19-9-13-21(14-10-19)23-16-6-4-2/h7-16H,3-6,17H2,1-2H3
InChIKey
HULWIRGKKACUSP-UHFFFAOYSA-N
Compound name
N-[4-[[4-(butylideneamino)phenyl]methyl]phenyl]butan-1-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.2096 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.21688 177.1
[M+Na]+ 329.19882 182.4
[M-H]- 305.20232 185.5
[M+NH4]+ 324.24342 192.8
[M+K]+ 345.17276 177.2
[M+H-H2O]+ 289.20686 167.5
[M+HCOO]- 351.20780 204.5
[M+CH3COO]- 365.22345 217.3
[M+Na-2H]- 327.18427 181.5
[M]+ 306.20905 180.1
[M]- 306.21015 180.1
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.