CID 15345825

195053-89-5

Structural Information

Molecular Formula
C25H25N3
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)N4C=C(N=C4)CCCN
InChI
InChI=1S/C25H25N3/c26-18-10-17-24-19-28(20-27-24)25(21-11-4-1-5-12-21,22-13-6-2-7-14-22)23-15-8-3-9-16-23/h1-9,11-16,19-20H,10,17-18,26H2
InChIKey
PQVLJKLTNMOGBT-UHFFFAOYSA-N
Compound name
3-(1-tritylimidazol-4-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

121
Patents

367.20483 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 368.21211 190.2
[M+Na]+ 390.19405 194.8
[M-H]- 366.19755 199.0
[M+NH4]+ 385.23865 199.7
[M+K]+ 406.16799 186.9
[M+H-H2O]+ 350.20209 178.4
[M+HCOO]- 412.20303 210.1
[M+CH3COO]- 426.21868 198.8
[M+Na-2H]- 388.17950 194.1
[M]+ 367.20428 187.6
[M]- 367.20538 187.6
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

patents stripe