CID 11105434

(bromomethoxy)ethane

Structural Information

Molecular Formula
C3H7BrO
SMILES
CCOCBr
InChI
InChI=1S/C3H7BrO/c1-2-5-3-4/h2-3H2,1H3
InChIKey
CYYWAXVARNZFBI-UHFFFAOYSA-N
Compound name
bromomethoxyethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

646
Patents

137.96803 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.97531 118.5
[M+Na]+ 160.95725 130.5
[M-H]- 136.96075 122.1
[M+NH4]+ 156.00185 143.9
[M+K]+ 176.93119 121.8
[M+H-H2O]+ 120.96529 120.0
[M+HCOO]- 182.96623 141.0
[M+CH3COO]- 196.98188 171.7
[M+Na-2H]- 158.94270 128.3
[M]+ 137.96748 138.4
[M]- 137.96858 138.4
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