CID 75906

6-bromo-1-hexene

Structural Information

Molecular Formula
C6H11Br
SMILES
C=CCCCCBr
InChI
InChI=1S/C6H11Br/c1-2-3-4-5-6-7/h2H,1,3-6H2
InChIKey
RIMXEJYJXDBLIE-UHFFFAOYSA-N
Compound name
6-bromohex-1-ene
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

5
References

2471
Patents

162.00441 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.011686 127.9
[M+Na]+ 184.993628 139.0
[M-H]- 160.997134 131.0
[M+NH4]+ 180.038233 152.3
[M+K]+ 200.967568 128.5
[M+H-H2O]+ 145.001670 129.1
[M+HCOO]- 207.002611 149.4
[M+CH3COO]- 221.018261 177.5
[M+Na-2H]- 182.979076 136.2
[M]+ 162.00386142 146.8
[M]- 162.00495858 146.8
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