CID 88577576

3-methoxycyclobutane-1-thiol

Structural Information

Molecular Formula
C5H10OS
SMILES
COC1CC(C1)S
InChI
InChI=1S/C5H10OS/c1-6-4-2-5(7)3-4/h4-5,7H,2-3H2,1H3
InChIKey
UKXBOAQRZGCRPX-UHFFFAOYSA-N
Compound name
3-methoxycyclobutane-1-thiol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

118.045235 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 119.05251 116.0
[M+Na]+ 141.03445 122.5
[M+NH4]+ 136.07906 122.0
[M+K]+ 157.00839 117.5
[M-H]- 117.03796 115.3
[M+Na-2H]- 139.01990 118.8
[M]+ 118.04469 116.0
[M]- 118.04578 116.0
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.