CID 66345717

1-bromo-3-methoxycyclobutane

Structural Information

Molecular Formula
C5H9BrO
SMILES
COC1CC(C1)Br
InChI
InChI=1S/C5H9BrO/c1-7-5-2-4(6)3-5/h4-5H,2-3H2,1H3
InChIKey
YBVXRWXSBZVVRL-UHFFFAOYSA-N
Compound name
1-bromo-3-methoxycyclobutane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.98367 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.99095 116.5
[M+Na]+ 186.97289 126.9
[M-H]- 162.97639 123.0
[M+NH4]+ 182.01749 134.9
[M+K]+ 202.94683 121.0
[M+H-H2O]+ 146.98093 113.3
[M+HCOO]- 208.98187 137.1
[M+CH3COO]- 222.99752 179.8
[M+Na-2H]- 184.95834 125.1
[M]+ 163.98312 142.5
[M]- 163.98422 142.5
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.