CID 165992266

4-(bromomethyl)-2-oxabicyclo[2.2.1]heptane

Structural Information

Molecular Formula
C7H11BrO
SMILES
C1CC2(CC1OC2)CBr
InChI
InChI=1S/C7H11BrO/c8-4-7-2-1-6(3-7)9-5-7/h6H,1-5H2
InChIKey
HTMKFCISVBJWGR-UHFFFAOYSA-N
Compound name
4-(bromomethyl)-2-oxabicyclo[2.2.1]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.99933 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.00661 143.2
[M+Na]+ 212.98855 143.3
[M+NH4]+ 208.03315 150.6
[M+K]+ 228.96249 144.6
[M-H]- 188.99205 143.5
[M+Na-2H]- 210.97400 143.2
[M]+ 189.99878 142.1
[M]- 189.99988 142.1
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.