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]+ 320.848376 143.9
[M+Na]+ 342.830318 151.9
[M-H]- 318.833824 147.7
[M+NH4]+ 337.874923 159.7
[M+K]+ 358.804258 136.0
[M+H-H2O]+ 302.838360 158.6
[M+HCOO]- 364.839301 152.6
[M+CH3COO]- 378.854951 217.7
[M+Na-2H]- 340.815766 148.9
[M]+ 319.84055142 184.1
[M]- 319.84164858 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.