CID 205215

Brn 1977227

Structural Information

Molecular Formula
C7H17NO4S4
SMILES
CN(C)C(CSS(=O)(=O)C)CSS(=O)(=O)C
InChI
InChI=1S/C7H17NO4S4/c1-8(2)7(5-13-15(3,9)10)6-14-16(4,11)12/h7H,5-6H2,1-4H3
InChIKey
URMSKOIPICHNCM-UHFFFAOYSA-N
Compound name
N,N-dimethyl-1,3-bis(methylsulfonylsulfanyl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.00403 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.01131 170.5
[M+Na]+ 329.99325 174.2
[M+NH4]+ 325.03785 175.6
[M+K]+ 345.96719 166.1
[M-H]- 305.99675 167.7
[M+Na-2H]- 327.97870 168.4
[M]+ 307.00348 171.6
[M]- 307.00458 171.6
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.