CID 19326

Beta-2-diphenylmethyl-2-methyl-4-(2-piperidyl)-1,3-dioxolane hydrochloride

Structural Information

Molecular Formula
C22H27NO2
SMILES
CC1(OCC(O1)C2CCCCN2)C(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C22H27NO2/c1-22(24-16-20(25-22)19-14-8-9-15-23-19)21(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-7,10-13,19-21,23H,8-9,14-16H2,1H3
InChIKey
DNTLSXYDTJOADP-UHFFFAOYSA-N
Compound name
2-(2-benzhydryl-2-methyl-1,3-dioxolan-4-yl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.2042 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.21148 182.9
[M+Na]+ 360.19342 184.8
[M-H]- 336.19692 192.4
[M+NH4]+ 355.23802 193.8
[M+K]+ 376.16736 182.0
[M+H-H2O]+ 320.20146 173.1
[M+HCOO]- 382.20240 195.5
[M+CH3COO]- 396.21805 191.1
[M+Na-2H]- 358.17887 183.1
[M]+ 337.20365 175.8
[M]- 337.20475 175.8
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.