CID 101137

1,3-dioxolane, 4-methyl-2-(2-phenylethenyl)-

Structural Information

Molecular Formula
C12H14O2
SMILES
CC1COC(O1)C=CC2=CC=CC=C2
InChI
InChI=1S/C12H14O2/c1-10-9-13-12(14-10)8-7-11-5-3-2-4-6-11/h2-8,10,12H,9H2,1H3
InChIKey
MQLAQZSLFAOEAK-UHFFFAOYSA-N
Compound name
4-methyl-2-(2-phenylethenyl)-1,3-dioxolane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

63
Patents

190.09938 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.10666 141.5
[M+Na]+ 213.08860 154.3
[M+NH4]+ 208.13320 150.5
[M+K]+ 229.06254 149.5
[M-H]- 189.09210 147.8
[M+Na-2H]- 211.07405 147.8
[M]+ 190.09883 145.1
[M]- 190.09993 145.1
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