CID 97838

2-benzyl-4-phenyl-1,3-dioxolane

Structural Information

Molecular Formula
C16H16O2
SMILES
C1C(OC(O1)CC2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C16H16O2/c1-3-7-13(8-4-1)11-16-17-12-15(18-16)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2
InChIKey
WIAZXGHBTOASSQ-UHFFFAOYSA-N
Compound name
2-benzyl-4-phenyl-1,3-dioxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.11504 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.12232 154.2
[M+Na]+ 263.10426 169.2
[M+NH4]+ 258.14886 164.1
[M+K]+ 279.07820 163.1
[M-H]- 239.10776 163.5
[M+Na-2H]- 261.08971 163.8
[M]+ 240.11449 159.2
[M]- 240.11559 159.2
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.