CID 207032

Brn 0388620

Structural Information

Molecular Formula
C8H16N2S2
SMILES
CN(C)C1CCN(CC1)C(=S)S
InChI
InChI=1S/C8H16N2S2/c1-9(2)7-3-5-10(6-4-7)8(11)12/h7H,3-6H2,1-2H3,(H,11,12)
InChIKey
DXEQYGVSRDSYKB-UHFFFAOYSA-N
Compound name
4-(dimethylamino)piperidine-1-carbodithioic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.07549 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.08277 141.9
[M+Na]+ 227.06471 147.1
[M-H]- 203.06821 144.5
[M+NH4]+ 222.10931 160.6
[M+K]+ 243.03865 144.7
[M+H-H2O]+ 187.07275 135.3
[M+HCOO]- 249.07369 150.5
[M+CH3COO]- 263.08934 189.4
[M+Na-2H]- 225.05016 140.3
[M]+ 204.07494 140.2
[M]- 204.07604 140.2
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.