CID 59209

102107-28-8

Structural Information

Molecular Formula
C21H25NO2
SMILES
CN1CCCCC1C2COC(O2)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C21H25NO2/c1-22-15-9-8-14-19(22)20-16-23-21(24-20,17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-7,10-13,19-20H,8-9,14-16H2,1H3
InChIKey
RPCWBNGIMNMRSU-UHFFFAOYSA-N
Compound name
2-(2,2-diphenyl-1,3-dioxolan-4-yl)-1-methylpiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

323.18854 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.19582 178.3
[M+Na]+ 346.17776 182.4
[M-H]- 322.18126 189.6
[M+NH4]+ 341.22236 190.9
[M+K]+ 362.15170 180.1
[M+H-H2O]+ 306.18580 168.3
[M+HCOO]- 368.18674 193.8
[M+CH3COO]- 382.20239 188.1
[M+Na-2H]- 344.16321 179.8
[M]+ 323.18799 173.6
[M]- 323.18909 173.6
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