CID 24031

2-benzyl-4-(2-piperidyl)-1,3-dioxolane hydrochloride

Structural Information

Molecular Formula
C15H21NO2
SMILES
C1CCNC(C1)C2COC(O2)CC3=CC=CC=C3
InChI
InChI=1S/C15H21NO2/c1-2-6-12(7-3-1)10-15-17-11-14(18-15)13-8-4-5-9-16-13/h1-3,6-7,13-16H,4-5,8-11H2
InChIKey
BFIHVAAIQMHVLM-UHFFFAOYSA-N
Compound name
2-(2-benzyl-1,3-dioxolan-4-yl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

247.15723 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.16451 157.8
[M+Na]+ 270.14645 160.8
[M-H]- 246.14995 164.5
[M+NH4]+ 265.19105 171.2
[M+K]+ 286.12039 159.1
[M+H-H2O]+ 230.15449 149.7
[M+HCOO]- 292.15543 172.6
[M+CH3COO]- 306.17108 167.9
[M+Na-2H]- 268.13190 160.1
[M]+ 247.15668 151.4
[M]- 247.15778 151.4
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.