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

15
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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.