CID 21525286

Sulfonium, dimethyl(2-phenylethyl)-, iodide

Structural Information

Molecular Formula
C10H15S
SMILES
C[S+](C)CCC1=CC=CC=C1
InChI
InChI=1S/C10H15S/c1-11(2)9-8-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3/q+1
InChIKey
SRWLGDMHQDLOSA-UHFFFAOYSA-N
Compound name
dimethyl(2-phenylethyl)sulfanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

167.08945 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.09673 131.8
[M+Na]+ 190.07867 146.8
[M+NH4]+ 185.12327 143.4
[M+K]+ 206.05261 138.0
[M-H]- 166.08217 137.1
[M+Na-2H]- 188.06412 140.4
[M]+ 167.08890 136.5
[M]- 167.09000 136.5
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