CID 83413

2-trimethylsilyl-1,3-dithiane

Structural Information

Molecular Formula
C7H16S2Si
SMILES
C[Si](C)(C)C1SCCCS1
InChI
InChI=1S/C7H16S2Si/c1-10(2,3)7-8-5-4-6-9-7/h7H,4-6H2,1-3H3
InChIKey
BTTUMVHWIAXYPJ-UHFFFAOYSA-N
Compound name
1,3-dithian-2-yl(trimethyl)silane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

529
Patents

192.04626 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.05354 138.3
[M+Na]+ 215.03548 143.6
[M-H]- 191.03898 140.8
[M+NH4]+ 210.08008 158.9
[M+K]+ 231.00942 140.8
[M+H-H2O]+ 175.04352 133.1
[M+HCOO]- 237.04446 146.3
[M+CH3COO]- 251.06011 178.9
[M+Na-2H]- 213.02093 138.8
[M]+ 192.04571 136.2
[M]- 192.04681 136.2
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