CID 16683898

Bis[[(2s)-2-amino-3-hydroxy-3-oxo-propyl]sulfanyl]mercury

Structural Information

Molecular Formula
C6H12HgN2O4S2
SMILES
C([C@H](C(=O)O)N)S[Hg]SC[C@H](C(=O)O)N
InChI
InChI=1S/2C3H7NO2S.Hg/c2*4-2(1-7)3(5)6;/h2*2,7H,1,4H2,(H,5,6);/q;;+2/p-2/t2*2-;/m11./s1
InChIKey
SVRCCJGEYPCELC-JCWNAWFTSA-L
Compound name
bis[[(2S)-2-amino-2-carboxyethyl]sulfanyl]mercury
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

441.9945 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 443.001776 188.3
[M+Na]+ 464.983718 188.8
[M-H]- 440.987224 181.6
[M+NH4]+ 460.028323 199.9
[M+K]+ 480.957658 184.0
[M+H-H2O]+ 424.991760 179.6
[M+HCOO]- 486.992701 192.5
[M+CH3COO]- 501.008351 199.8
[M+Na-2H]- 462.969166 180.2
[M]+ 441.99395142 186.6
[M]- 441.99504858 186.6
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.