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

8
Patents

160.0922 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.09948 135.2
[M+Na]+ 183.08142 141.9
[M-H]- 159.08492 135.4
[M+NH4]+ 178.12602 156.8
[M+K]+ 199.05536 140.1
[M+H-H2O]+ 143.08946 130.2
[M+HCOO]- 205.09040 153.3
[M+CH3COO]- 219.10605 178.3
[M+Na-2H]- 181.06687 137.7
[M]+ 160.09165 140.1
[M]- 160.09275 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