CID 70293

2-phenyl-1,3-dioxolane

Structural Information

Molecular Formula
C9H10O2
SMILES
C1COC(O1)C2=CC=CC=C2
InChI
InChI=1S/C9H10O2/c1-2-4-8(5-3-1)9-10-6-7-11-9/h1-5,9H,6-7H2
InChIKey
LYINTWKRUWVLBA-UHFFFAOYSA-N
Compound name
2-phenyl-1,3-dioxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

1337
Patents

150.06808 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.07536 128.8
[M+Na]+ 173.05730 141.9
[M+NH4]+ 168.10190 138.6
[M+K]+ 189.03124 137.7
[M-H]- 149.06080 135.5
[M+Na-2H]- 171.04275 136.4
[M]+ 150.06753 132.6
[M]- 150.06863 132.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe