CID 3032956

Brn 2362898

Structural Information

Molecular Formula
C9H19N3S2
SMILES
CNC(=S)C(CCN(C)C)C(=S)NC
InChI
InChI=1S/C9H19N3S2/c1-10-8(13)7(9(14)11-2)5-6-12(3)4/h7H,5-6H2,1-4H3,(H,10,13)(H,11,14)
InChIKey
RXLSOFRQNQORDN-UHFFFAOYSA-N
Compound name
2-[2-(dimethylamino)ethyl]-N,N'-dimethylpropanedithioamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.10204 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.10932 154.8
[M+Na]+ 256.09126 159.5
[M+NH4]+ 251.13586 161.8
[M+K]+ 272.06520 152.3
[M-H]- 232.09476 155.3
[M+Na-2H]- 254.07671 155.6
[M]+ 233.10149 156.0
[M]- 233.10259 156.0
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.