CID 121793

Ammonium, dithiodiethylenebis(triethyl-, dibromide

Structural Information

Molecular Formula
C16H38N2S2
SMILES
CC[N+](CC)(CC)CCSSCC[N+](CC)(CC)CC
InChI
InChI=1S/C16H38N2S2/c1-7-17(8-2,9-3)13-15-19-20-16-14-18(10-4,11-5)12-6/h7-16H2,1-6H3/q+2
InChIKey
MGCKGLNJYKQHBM-UHFFFAOYSA-N
Compound name
triethyl-[2-[2-(triethylazaniumyl)ethyldisulfanyl]ethyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

322.24765 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.25493 167.4
[M+Na]+ 345.23687 169.8
[M-H]- 321.24037 168.9
[M+NH4]+ 340.28147 183.1
[M+K]+ 361.21081 155.8
[M+H-H2O]+ 305.24491 165.4
[M+HCOO]- 367.24585 177.6
[M+CH3COO]- 381.26150 209.2
[M+Na-2H]- 343.22232 172.5
[M]+ 322.24710 171.3
[M]- 322.24820 171.3
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.