CID 53651300

1,2,4-tribromo-2,3-dimethylbutane

Structural Information

Molecular Formula
C6H11Br3
SMILES
CC(CBr)C(C)(CBr)Br
InChI
InChI=1S/C6H11Br3/c1-5(3-7)6(2,9)4-8/h5H,3-4H2,1-2H3
InChIKey
FUGHSMCHVRINIM-UHFFFAOYSA-N
Compound name
1,2,4-tribromo-2,3-dimethylbutane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

319.8411 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.84838 143.9
[M+Na]+ 342.83032 151.9
[M-H]- 318.83382 147.7
[M+NH4]+ 337.87492 159.7
[M+K]+ 358.80426 136.0
[M+H-H2O]+ 302.83836 158.6
[M+HCOO]- 364.83930 152.6
[M+CH3COO]- 378.85495 217.7
[M+Na-2H]- 340.81577 148.9
[M]+ 319.84055 184.1
[M]- 319.84165 184.1
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.