CID 552870

1-(trimethylsilyl)cyclopropyl phenyl sulfide

Structural Information

Molecular Formula
C12H18SSi
SMILES
C[Si](C)(C)C1(CC1)SC2=CC=CC=C2
InChI
InChI=1S/C12H18SSi/c1-14(2,3)12(9-10-12)13-11-7-5-4-6-8-11/h4-8H,9-10H2,1-3H3
InChIKey
DEIZBLNWJYTTLE-UHFFFAOYSA-N
Compound name
trimethyl-(1-phenylsulfanylcyclopropyl)silane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.08984 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.09712 143.2
[M+Na]+ 245.07906 151.8
[M-H]- 221.08256 150.6
[M+NH4]+ 240.12366 159.9
[M+K]+ 261.05300 149.5
[M+H-H2O]+ 205.08710 137.4
[M+HCOO]- 267.08804 160.2
[M+CH3COO]- 281.10369 189.0
[M+Na-2H]- 243.06451 148.6
[M]+ 222.08929 147.6
[M]- 222.09039 147.6
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

No patent data available for this compound.