CID 24022

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

Structural Information

Molecular Formula
C14H19NO2
SMILES
C1CCNC(C1)C2COC(O2)C3=CC=CC=C3
InChI
InChI=1S/C14H19NO2/c1-2-6-11(7-3-1)14-16-10-13(17-14)12-8-4-5-9-15-12/h1-3,6-7,12-15H,4-5,8-10H2
InChIKey
XKGUUISNOPCNKA-UHFFFAOYSA-N
Compound name
2-(2-phenyl-1,3-dioxolan-4-yl)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

233.14159 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.14887 153.3
[M+Na]+ 256.13081 156.7
[M-H]- 232.13431 160.2
[M+NH4]+ 251.17541 167.2
[M+K]+ 272.10475 155.2
[M+H-H2O]+ 216.13885 145.3
[M+HCOO]- 278.13979 168.4
[M+CH3COO]- 292.15544 163.8
[M+Na-2H]- 254.11626 156.1
[M]+ 233.14104 146.5
[M]- 233.14214 146.5
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.