CID 78271

2-bromoethyl methacrylate

Structural Information

Molecular Formula
C6H9BrO2
SMILES
CC(=C)C(=O)OCCBr
InChI
InChI=1S/C6H9BrO2/c1-5(2)6(8)9-4-3-7/h1,3-4H2,2H3
InChIKey
AOUSBQVEVZBMNI-UHFFFAOYSA-N
Compound name
2-bromoethyl 2-methylprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

2206
Patents

191.97859 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.98587 132.9
[M+Na]+ 214.96781 143.8
[M-H]- 190.97131 136.1
[M+NH4]+ 210.01241 156.0
[M+K]+ 230.94175 134.3
[M+H-H2O]+ 174.97585 133.8
[M+HCOO]- 236.97679 153.2
[M+CH3COO]- 250.99244 181.0
[M+Na-2H]- 212.95326 138.7
[M]+ 191.97804 152.6
[M]- 191.97914 152.6
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