CID 96274

Nsc 64825

Structural Information

Molecular Formula
C34H40N4
SMILES
CN(C)C1=CC=C(C=C1)C(=C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C)C4=CC=C(C=C4)N(C)C
InChI
InChI=1S/C34H40N4/c1-35(2)29-17-9-25(10-18-29)33(26-11-19-30(20-12-26)36(3)4)34(27-13-21-31(22-14-27)37(5)6)28-15-23-32(24-16-28)38(7)8/h9-24H,1-8H3
InChIKey
PJZWENDBSVLVEB-UHFFFAOYSA-N
Compound name
N,N-dimethyl-4-[1,2,2-tris[4-(dimethylamino)phenyl]ethenyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

13
Patents

504.3253 Da
Monoisotopic Mass

8.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 505.33258 232.5
[M+Na]+ 527.31452 232.8
[M-H]- 503.31802 248.4
[M+NH4]+ 522.35912 239.0
[M+K]+ 543.28846 230.2
[M+H-H2O]+ 487.32256 218.7
[M+HCOO]- 549.32350 255.9
[M+CH3COO]- 563.33915 269.8
[M+Na-2H]- 525.29997 228.7
[M]+ 504.32475 234.6
[M]- 504.32585 234.6
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