CID 2748414

1-tritylpiperidin-4-one

Structural Information

Molecular Formula
C24H23NO
SMILES
C1CN(CCC1=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C24H23NO/c26-23-16-18-25(19-17-23)24(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-15H,16-19H2
InChIKey
TTWLMWSWSQUXDB-UHFFFAOYSA-N
Compound name
1-tritylpiperidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

63
Patents

341.17798 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.185256 183.9
[M+Na]+ 364.167198 187.0
[M-H]- 340.170704 193.3
[M+NH4]+ 359.211803 194.0
[M+K]+ 380.141138 180.3
[M+H-H2O]+ 324.175240 172.3
[M+HCOO]- 386.176181 200.2
[M+CH3COO]- 400.191831 192.3
[M+Na-2H]- 362.152646 188.2
[M]+ 341.17743142 177.4
[M]- 341.17852858 177.4
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