CID 23089

2-(butylthio)ethyl vinyl ether

Structural Information

Molecular Formula
C8H16OS
SMILES
CCCCSCCOC=C
InChI
InChI=1S/C8H16OS/c1-3-5-7-10-8-6-9-4-2/h4H,2-3,5-8H2,1H3
InChIKey
GZHKEFMXFNGIDG-UHFFFAOYSA-N
Compound name
1-(2-ethenoxyethylsulfanyl)butane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

160.0922 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.099476 135.2
[M+Na]+ 183.081418 141.9
[M-H]- 159.084924 135.4
[M+NH4]+ 178.126023 156.8
[M+K]+ 199.055358 140.1
[M+H-H2O]+ 143.089460 130.2
[M+HCOO]- 205.090401 153.3
[M+CH3COO]- 219.106051 178.3
[M+Na-2H]- 181.066866 137.7
[M]+ 160.09165142 140.1
[M]- 160.09274858 140.1
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

patents stripe