CID 6305749

Nsc268742

Structural Information

Molecular Formula
C26H24N2
SMILES
CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)/C=C/C3=CC=NC4=CC=CC=C34
InChI
InChI=1S/C26H24N2/c1-2-28(20-22-8-4-3-5-9-22)24-16-13-21(14-17-24)12-15-23-18-19-27-26-11-7-6-10-25(23)26/h3-19H,2,20H2,1H3/b15-12+
InChIKey
KIAAAPJWBOUOAV-NTCAYCPXSA-N
Compound name
N-benzyl-N-ethyl-4-[(E)-2-quinolin-4-ylethenyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

364.19394 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.20122 191.8
[M+Na]+ 387.18316 197.1
[M-H]- 363.18666 200.9
[M+NH4]+ 382.22776 203.1
[M+K]+ 403.15710 189.4
[M+H-H2O]+ 347.19120 179.7
[M+HCOO]- 409.19214 213.0
[M+CH3COO]- 423.20779 201.0
[M+Na-2H]- 385.16861 197.0
[M]+ 364.19339 191.5
[M]- 364.19449 191.5
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.