CID 10750290

2-(bromomethyl)-2-ethenyl-1,3-dioxolane

Structural Information

Molecular Formula
C6H9BrO2
SMILES
C=CC1(OCCO1)CBr
InChI
InChI=1S/C6H9BrO2/c1-2-6(5-7)8-3-4-9-6/h2H,1,3-5H2
InChIKey
KPDPJISYABQVRB-UHFFFAOYSA-N
Compound name
2-(bromomethyl)-2-ethenyl-1,3-dioxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.97859 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.98587 133.5
[M+Na]+ 214.96781 144.6
[M-H]- 190.97131 140.7
[M+NH4]+ 210.01241 157.5
[M+K]+ 230.94175 137.3
[M+H-H2O]+ 174.97585 135.6
[M+HCOO]- 236.97679 153.3
[M+CH3COO]- 250.99244 176.9
[M+Na-2H]- 212.95326 143.0
[M]+ 191.97804 152.5
[M]- 191.97914 152.5
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.