CID 24868317

(3-triphenylmethylaminomethyl)pyridine

Structural Information

Molecular Formula
C25H22N2
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)NCC4=CN=CC=C4
InChI
InChI=1S/C25H22N2/c1-4-12-22(13-5-1)25(23-14-6-2-7-15-23,24-16-8-3-9-17-24)27-20-21-11-10-18-26-19-21/h1-19,27H,20H2
InChIKey
PQFNWDHABGBCHB-UHFFFAOYSA-N
Compound name
1,1,1-triphenyl-N-(pyridin-3-ylmethyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

21
References

17
Patents

350.17828 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.18556 185.1
[M+Na]+ 373.16750 188.9
[M-H]- 349.17100 194.7
[M+NH4]+ 368.21210 194.4
[M+K]+ 389.14144 181.1
[M+H-H2O]+ 333.17554 173.2
[M+HCOO]- 395.17648 205.8
[M+CH3COO]- 409.19213 193.9
[M+Na-2H]- 371.15295 193.3
[M]+ 350.17773 181.3
[M]- 350.17883 181.3
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