CID 33272

Iodo(p-tolyl)mercury

Structural Information

Molecular Formula
C7H7HgI
SMILES
CC1=CC=C(C=C1)[Hg]I
InChI
InChI=1S/C7H7.Hg.HI/c1-7-5-3-2-4-6-7;;/h3-6H,1H3;;1H/q;+1;/p-1
InChIKey
VAGBSLXKARYETR-UHFFFAOYSA-M
Compound name
iodo-(4-methylphenyl)mercury
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

419.9299 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 420.93718 167.8
[M+Na]+ 442.91912 167.7
[M-H]- 418.92262 163.2
[M+NH4]+ 437.96372 183.3
[M+K]+ 458.89306 170.7
[M+H-H2O]+ 402.92716 157.1
[M+HCOO]- 464.92810 185.2
[M+CH3COO]- 478.94375 188.6
[M+Na-2H]- 440.90457 159.5
[M]+ 419.92935 165.3
[M]- 419.93045 165.3
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.