CID 138006

2-methyl-2-phenyl-1,3-dioxolane

Structural Information

Molecular Formula
C10H12O2
SMILES
CC1(OCCO1)C2=CC=CC=C2
InChI
InChI=1S/C10H12O2/c1-10(11-7-8-12-10)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3
InChIKey
GAOQAPRPYXWTFK-UHFFFAOYSA-N
Compound name
2-methyl-2-phenyl-1,3-dioxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

199
Patents

164.08372 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.09100 132.0
[M+Na]+ 187.07294 139.4
[M-H]- 163.07644 140.0
[M+NH4]+ 182.11754 153.5
[M+K]+ 203.04688 140.3
[M+H-H2O]+ 147.08098 127.0
[M+HCOO]- 209.08192 154.3
[M+CH3COO]- 223.09757 146.7
[M+Na-2H]- 185.05839 140.7
[M]+ 164.08317 132.0
[M]- 164.08427 132.0
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.