CID 11805619

2-(2-bromoethyl)-2-methyl-1,3-dioxolane

Structural Information

Molecular Formula
C6H11BrO2
SMILES
CC1(OCCO1)CCBr
InChI
InChI=1S/C6H11BrO2/c1-6(2-3-7)8-4-5-9-6/h2-5H2,1H3
InChIKey
SZLPRRVCSGZARF-UHFFFAOYSA-N
Compound name
2-(2-bromoethyl)-2-methyl-1,3-dioxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

204
Patents

193.99425 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.00153 138.6
[M+Na]+ 216.98347 139.9
[M+NH4]+ 212.02807 144.8
[M+K]+ 232.95741 140.8
[M-H]- 192.98697 140.5
[M+Na-2H]- 214.96892 140.5
[M]+ 193.99370 138.2
[M]- 193.99480 138.2
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

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