CID 21125260

72102-64-8

Structural Information

Molecular Formula
C26H32N3
SMILES
CCNC1=C(C=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C)C
InChI
InChI=1S/C26H31N3/c1-7-27-25-17-12-22(18-19(25)2)26(20-8-13-23(14-9-20)28(3)4)21-10-15-24(16-11-21)29(5)6/h8-18H,7H2,1-6H3/p+1
InChIKey
FCAMDCXNCBYMAO-UHFFFAOYSA-O
Compound name
[4-[[4-(dimethylamino)phenyl]-[4-(ethylamino)-3-methylphenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

386.2596 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 387.26688 199.7
[M+Na]+ 409.24882 214.9
[M+NH4]+ 404.29342 208.8
[M+K]+ 425.22276 206.2
[M-H]- 385.25232 210.6
[M+Na-2H]- 407.23427 210.4
[M]+ 386.25905 205.4
[M]- 386.26015 205.4
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.