CID 83093

Bromomethyl methyl ether

Structural Information

Molecular Formula
C2H5BrO
SMILES
COCBr
InChI
InChI=1S/C2H5BrO/c1-4-2-3/h2H2,1H3
InChIKey
JAMFGQBENKSWOF-UHFFFAOYSA-N
Compound name
bromo(methoxy)methane
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

4510
Patents

123.95238 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.95966 113.8
[M+Na]+ 146.94160 126.2
[M-H]- 122.94510 117.6
[M+NH4]+ 141.98620 139.7
[M+K]+ 162.91554 117.7
[M+H-H2O]+ 106.94964 115.5
[M+HCOO]- 168.95058 136.6
[M+CH3COO]- 182.96623 168.8
[M+Na-2H]- 144.92705 124.2
[M]+ 123.95183 133.4
[M]- 123.95293 133.4
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