CID 121553408

3-bromocyclobutan-1-ol

Structural Information

Molecular Formula
C4H7BrO
SMILES
C1C(CC1Br)O
InChI
InChI=1S/C4H7BrO/c5-3-1-4(6)2-3/h3-4,6H,1-2H2
InChIKey
HWLHFIFQJICDNX-UHFFFAOYSA-N
Compound name
3-bromocyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

149.96803 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.97531 113.9
[M+Na]+ 172.95725 124.2
[M-H]- 148.96075 119.2
[M+NH4]+ 168.00185 132.1
[M+K]+ 188.93119 117.5
[M+H-H2O]+ 132.96529 110.9
[M+HCOO]- 194.96623 133.3
[M+CH3COO]- 208.98188 174.6
[M+Na-2H]- 170.94270 122.3
[M]+ 149.96748 137.7
[M]- 149.96858 137.7
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

patents stripe