CID 21257

Chloro(trans-2-methoxycyclooctyl)mercury

Structural Information

Molecular Formula
C9H17ClHgO
SMILES
COC1CCCCCCC1[Hg]Cl
InChI
InChI=1S/C9H17O.ClH.Hg/c1-10-9-7-5-3-2-4-6-8-9;;/h7,9H,2-6,8H2,1H3;1H;/q;;+1/p-1
InChIKey
UIGCAKPIVWEXRT-UHFFFAOYSA-M
Compound name
chloro-(2-methoxycyclooctyl)mercury
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

378.06744 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.07472 167.2
[M+Na]+ 401.05666 170.8
[M-H]- 377.06016 168.0
[M+NH4]+ 396.10126 175.6
[M+K]+ 417.03060 170.1
[M+H-H2O]+ 361.06470 163.2
[M+HCOO]- 423.06564 173.1
[M+CH3COO]- 437.08129 225.0
[M+Na-2H]- 399.04211 165.0
[M]+ 378.06689 166.5
[M]- 378.06799 166.5
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

No patent data available for this compound.