CID 118243

35493-94-8

Structural Information

Molecular Formula
C23H29N
SMILES
C1CC(C1)CN2CCC(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C23H29N/c1-3-10-20(11-4-1)23(21-12-5-2-6-13-21)22-14-16-24(17-15-22)18-19-8-7-9-19/h1-6,10-13,19,22-23H,7-9,14-18H2
InChIKey
YCXGVQATDFLKMG-UHFFFAOYSA-N
Compound name
4-benzhydryl-1-(cyclobutylmethyl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

319.23 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.23728 178.0
[M+Na]+ 342.21922 187.7
[M+NH4]+ 337.26382 183.8
[M+K]+ 358.19316 179.8
[M-H]- 318.22272 183.6
[M+Na-2H]- 340.20467 186.2
[M]+ 319.22945 179.9
[M]- 319.23055 179.9
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.