CID 3021597

Propane, 2-((2-(ethenylseleno)ethyl)thio)-

Structural Information

Molecular Formula
C7H16SSe
SMILES
CC[Se]CCSC(C)C
InChI
InChI=1S/C7H16SSe/c1-4-9-6-5-8-7(2)3/h7H,4-6H2,1-3H3
InChIKey
IZXFTROMQSSCPJ-UHFFFAOYSA-N
Compound name
2-(2-ethylselanylethylsulfanyl)propane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.0138 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.02108 145.6
[M+Na]+ 235.00302 151.3
[M-H]- 211.00652 145.4
[M+NH4]+ 230.04762 167.2
[M+K]+ 250.97696 149.8
[M+H-H2O]+ 195.01106 140.1
[M+HCOO]- 257.01200 161.5
[M+CH3COO]- 271.02765 180.5
[M+Na-2H]- 232.98847 145.6
[M]+ 212.01325 149.1
[M]- 212.01435 149.1
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.