CID 50598

Dimethylcarbamyl diethylthiocarbamyl sulfide

Structural Information

Molecular Formula
C8H16N2OS2
SMILES
CCN(CC)C(=S)SC(=O)N(C)C
InChI
InChI=1S/C8H16N2OS2/c1-5-10(6-2)8(12)13-7(11)9(3)4/h5-6H2,1-4H3
InChIKey
QOLYDISDVWIKFN-UHFFFAOYSA-N
Compound name
S-(diethylcarbamothioyl) N,N-dimethylcarbamothioate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.0704 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.07768 151.3
[M+Na]+ 243.05962 157.6
[M+NH4]+ 238.10422 158.8
[M+K]+ 259.03356 150.3
[M-H]- 219.06312 151.7
[M+Na-2H]- 241.04507 152.6
[M]+ 220.06985 152.9
[M]- 220.07095 152.9
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.