CID 38625

40709-82-8

Structural Information

Molecular Formula
C4H7ClOS
SMILES
C=CS(=O)CCCl
InChI
InChI=1S/C4H7ClOS/c1-2-7(6)4-3-5/h2H,1,3-4H2
InChIKey
WROKGYVSAYYTNV-UHFFFAOYSA-N
Compound name
1-chloro-2-ethenylsulfinylethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

137.99062 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.99790 125.3
[M+Na]+ 160.97984 136.5
[M+NH4]+ 156.02444 134.2
[M+K]+ 176.95378 128.4
[M-H]- 136.98334 125.0
[M+Na-2H]- 158.96529 128.9
[M]+ 137.99007 127.4
[M]- 137.99117 127.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe