CID 40070

Diheptylmercury

Structural Information

Molecular Formula
C14H30Hg
SMILES
CCCCCCC[Hg]CCCCCCC
InChI
InChI=1S/2C7H15.Hg/c2*1-3-5-7-6-4-2;/h2*1,3-7H2,2H3;
InChIKey
OWPLINHVUZVCHR-UHFFFAOYSA-N
Compound name
diheptylmercury
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

400.20538 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.212656 197.6
[M+Na]+ 423.194598 199.6
[M-H]- 399.198104 194.8
[M+NH4]+ 418.239203 214.7
[M+K]+ 439.168538 196.0
[M+H-H2O]+ 383.202640 189.7
[M+HCOO]- 445.203581 216.3
[M+CH3COO]- 459.219231 202.2
[M+Na-2H]- 421.180046 195.9
[M]+ 400.20483142 202.5
[M]- 400.20592858 202.5
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

patents stripe