CID 11147895

1-bromo-2,3-dimethylbut-2-ene

Structural Information

Molecular Formula
C6H11Br
SMILES
CC(=C(C)CBr)C
InChI
InChI=1S/C6H11Br/c1-5(2)6(3)4-7/h4H2,1-3H3
InChIKey
FOJZHDBSZUMAHU-UHFFFAOYSA-N
Compound name
1-bromo-2,3-dimethylbut-2-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

80
Patents

162.00441 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.01169 126.9
[M+Na]+ 184.99363 128.8
[M+NH4]+ 180.03823 132.1
[M+K]+ 200.96757 129.4
[M-H]- 160.99713 125.8
[M+Na-2H]- 182.97908 128.5
[M]+ 162.00386 125.6
[M]- 162.00496 125.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe