CID 111368

Oxetane, dibromo-

Structural Information

Molecular Formula
C3H4Br2O
SMILES
C1C(C(O1)Br)Br
InChI
InChI=1S/C3H4Br2O/c4-2-1-6-3(2)5/h2-3H,1H2
InChIKey
YHOHUAPVAAHWCW-UHFFFAOYSA-N
Compound name
2,3-dibromooxetane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

213.86288 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.870156 108.4
[M+Na]+ 236.852098 118.9
[M-H]- 212.855604 116.0
[M+NH4]+ 231.896703 124.6
[M+K]+ 252.826038 108.6
[M+H-H2O]+ 196.860140 113.7
[M+HCOO]- 258.861081 124.0
[M+CH3COO]- 272.876731 193.6
[M+Na-2H]- 234.837546 118.9
[M]+ 213.86233142 147.6
[M]- 213.86342858 147.6
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