CID 12466001

Cis-6-chloro-2-hexene

Structural Information

Molecular Formula
C6H11Cl
SMILES
C/C=C\CCCCl
InChI
InChI=1S/C6H11Cl/c1-2-3-4-5-6-7/h2-3H,4-6H2,1H3/b3-2-
InChIKey
SJHDJTNQXRYLLN-IHWYPQMZSA-N
Compound name
(Z)-6-chlorohex-2-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

118.05493 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 119.062206 122.9
[M+Na]+ 141.044148 131.3
[M-H]- 117.047654 123.1
[M+NH4]+ 136.088753 146.6
[M+K]+ 157.018088 128.5
[M+H-H2O]+ 101.052190 119.8
[M+HCOO]- 163.053131 142.4
[M+CH3COO]- 177.068781 169.8
[M+Na-2H]- 139.029596 129.8
[M]+ 118.05438142 125.1
[M]- 118.05547858 125.1
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

patents stripe