CID 213680

26864-94-8

Structural Information

Molecular Formula
C10H20N2S2
SMILES
CC1CN(CC(N1C(=S)S)C)C(C)C
InChI
InChI=1S/C10H20N2S2/c1-7(2)11-5-8(3)12(10(13)14)9(4)6-11/h7-9H,5-6H2,1-4H3,(H,13,14)
InChIKey
AUUKSGCUNJXWQX-UHFFFAOYSA-N
Compound name
2,6-dimethyl-4-propan-2-ylpiperazine-1-carbodithioic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.1068 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.11408 148.5
[M+Na]+ 255.09602 155.0
[M-H]- 231.09952 148.8
[M+NH4]+ 250.14062 165.0
[M+K]+ 271.06996 151.3
[M+H-H2O]+ 215.10406 142.3
[M+HCOO]- 277.10500 152.8
[M+CH3COO]- 291.12065 192.9
[M+Na-2H]- 253.08147 143.8
[M]+ 232.10625 147.7
[M]- 232.10735 147.7
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.