CID 13361075

2,2'-isopropylidenedithiobis(1-propylamine)

Structural Information

Molecular Formula
C9H22N2S2
SMILES
CC(CN)SC(C)(C)SC(C)CN
InChI
InChI=1S/C9H22N2S2/c1-7(5-10)12-9(3,4)13-8(2)6-11/h7-8H,5-6,10-11H2,1-4H3
InChIKey
BKQDFCKQIQWHMV-UHFFFAOYSA-N
Compound name
2-[2-(1-aminopropan-2-ylsulfanyl)propan-2-ylsulfanyl]propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.12244 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.12972 150.9
[M+Na]+ 245.11166 154.4
[M-H]- 221.11516 148.9
[M+NH4]+ 240.15626 168.4
[M+K]+ 261.08560 150.8
[M+H-H2O]+ 205.11970 144.5
[M+HCOO]- 267.12064 158.9
[M+CH3COO]- 281.13629 195.1
[M+Na-2H]- 243.09711 148.0
[M]+ 222.12189 150.3
[M]- 222.12299 150.3
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.