CID 98160

2-bromoundecane

Structural Information

Molecular Formula
C11H23Br
SMILES
CCCCCCCCCC(C)Br
InChI
InChI=1S/C11H23Br/c1-3-4-5-6-7-8-9-10-11(2)12/h11H,3-10H2,1-2H3
InChIKey
HAMCEMQAQYUVRF-UHFFFAOYSA-N
Compound name
2-bromoundecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

47
Patents

234.09831 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.10559 153.8
[M+Na]+ 257.08753 162.4
[M-H]- 233.09103 156.1
[M+NH4]+ 252.13213 175.5
[M+K]+ 273.06147 151.5
[M+H-H2O]+ 217.09557 153.9
[M+HCOO]- 279.09651 172.5
[M+CH3COO]- 293.11216 193.2
[M+Na-2H]- 255.07298 158.0
[M]+ 234.09776 174.5
[M]- 234.09886 174.5
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