CID 17885952

(2-chloroethoxy)cyclohexane

Structural Information

Molecular Formula
C8H15ClO
SMILES
C1CCC(CC1)OCCCl
InChI
InChI=1S/C8H15ClO/c9-6-7-10-8-4-2-1-3-5-8/h8H,1-7H2
InChIKey
VYZWMCQGQWBCHS-UHFFFAOYSA-N
Compound name
2-chloroethoxycyclohexane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

162.08115 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.088426 134.6
[M+Na]+ 185.070368 140.1
[M-H]- 161.073874 137.0
[M+NH4]+ 180.114973 155.9
[M+K]+ 201.044308 137.6
[M+H-H2O]+ 145.078410 129.9
[M+HCOO]- 207.079351 150.8
[M+CH3COO]- 221.095001 175.4
[M+Na-2H]- 183.055816 139.8
[M]+ 162.08060142 133.1
[M]- 162.08169858 133.1
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