CID 216080

1-(3,3-diphenylpropyl)-4-phenylpiperidine hydrochloride

Structural Information

Molecular Formula
C26H29N
SMILES
C1CN(CCC1C2=CC=CC=C2)CCC(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C26H29N/c1-4-10-22(11-5-1)23-16-19-27(20-17-23)21-18-26(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-15,23,26H,16-21H2
InChIKey
XHHIHBUVRJLGPM-UHFFFAOYSA-N
Compound name
1-(3,3-diphenylpropyl)-4-phenylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

355.23 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.23728 189.9
[M+Na]+ 378.21922 191.1
[M-H]- 354.22272 198.4
[M+NH4]+ 373.26382 199.3
[M+K]+ 394.19316 183.8
[M+H-H2O]+ 338.22726 177.5
[M+HCOO]- 400.22820 205.7
[M+CH3COO]- 414.24385 197.2
[M+Na-2H]- 376.20467 191.1
[M]+ 355.22945 183.1
[M]- 355.23055 183.1
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