CID 16684670

1,3-propanediamine, n-(2-((tetrahydro-8h-(1,3,2)thiazagermolo(2,3-b)(1,3,2)thiazagermol-8-yl)thio)ethyl)-, trihydrochloride

Structural Information

Molecular Formula
C9H21GeN3S3
SMILES
C1CS[Ge]2(N1CCS2)SCCNCCCN
InChI
InChI=1S/C9H21GeN3S3/c11-2-1-3-12-4-7-14-10-13(5-8-15-10)6-9-16-10/h12H,1-9,11H2
InChIKey
CKQFUGNUMYDSIS-UHFFFAOYSA-N
Compound name
N'-[2-(2,3,5,6-tetrahydro-[1,3,2]thiazagermolo[2,3-b][1,3,2]thiazagermol-8-ylsulfanyl)ethyl]propane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.01093 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.01821 163.1
[M+Na]+ 364.00015 168.6
[M-H]- 340.00365 162.8
[M+NH4]+ 359.04475 183.2
[M+K]+ 379.97409 163.3
[M+H-H2O]+ 324.00819 158.1
[M+HCOO]- 386.00913 167.6
[M+CH3COO]- 400.02478 171.8
[M+Na-2H]- 361.98560 162.7
[M]+ 341.01038 162.0
[M]- 341.01148 162.0
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.