CID 79299528

(1-bromo-2-methylpropyl)cyclohexane

Structural Information

Molecular Formula
C10H19Br
SMILES
CC(C)C(C1CCCCC1)Br
InChI
InChI=1S/C10H19Br/c1-8(2)10(11)9-6-4-3-5-7-9/h8-10H,3-7H2,1-2H3
InChIKey
MROSTGLYKMSTLB-UHFFFAOYSA-N
Compound name
(1-bromo-2-methylpropyl)cyclohexane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

218.06702 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.07430 142.6
[M+Na]+ 241.05624 143.8
[M+NH4]+ 236.10084 148.3
[M+K]+ 257.03018 143.7
[M-H]- 217.05974 143.4
[M+Na-2H]- 239.04169 144.6
[M]+ 218.06647 141.7
[M]- 218.06757 141.7
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.