CID 13614245

1,6-dibromohex-3-ene

Structural Information

Molecular Formula
C6H10Br2
SMILES
C(CBr)/C=C/CCBr
InChI
InChI=1S/C6H10Br2/c7-5-3-1-2-4-6-8/h1-2H,3-6H2/b2-1+
InChIKey
QBGNQGGJSCRVJJ-OWOJBTEDSA-N
Compound name
(E)-1,6-dibromohex-3-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

48
Patents

239.91493 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.92221 131.8
[M+Na]+ 262.90415 142.6
[M-H]- 238.90765 135.9
[M+NH4]+ 257.94875 153.0
[M+K]+ 278.87809 126.7
[M+H-H2O]+ 222.91219 140.2
[M+HCOO]- 284.91313 148.1
[M+CH3COO]- 298.92878 195.9
[M+Na-2H]- 260.88960 139.8
[M]+ 239.91438 165.8
[M]- 239.91548 165.8
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