CID 15523739

114429-91-3

Structural Information

Molecular Formula
C4H7BrO2
SMILES
C1[C@H]([C@@H](CO1)Br)O
InChI
InChI=1S/C4H7BrO2/c5-3-1-7-2-4(3)6/h3-4,6H,1-2H2/t3-,4-/m1/s1
InChIKey
LUUKWZNQWLUBGM-QWWZWVQMSA-N
Compound name
(3R,4R)-4-bromooxolan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

165.96294 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.970216 128.4
[M+Na]+ 188.952158 139.6
[M-H]- 164.955664 134.0
[M+NH4]+ 183.996763 152.3
[M+K]+ 204.926098 131.2
[M+H-H2O]+ 148.960200 129.8
[M+HCOO]- 210.961141 147.9
[M+CH3COO]- 224.976791 170.9
[M+Na-2H]- 186.937606 135.6
[M]+ 165.96239142 144.8
[M]- 165.96348858 144.8
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