CID 465311

Schembl18227294

Structural Information

Molecular Formula
C18H30N4OS2Si2
SMILES
C[Si](C)(CCCSC1=NC=CC=N1)O[Si](C)(C)CCCSC2=NC=CC=N2
InChI
InChI=1S/C18H30N4OS2Si2/c1-26(2,15-7-13-24-17-19-9-5-10-20-17)23-27(3,4)16-8-14-25-18-21-11-6-12-22-18/h5-6,9-12H,7-8,13-16H2,1-4H3
InChIKey
NLIZHCIFHLEBPJ-UHFFFAOYSA-N
Compound name
[dimethyl(3-pyrimidin-2-ylsulfanylpropyl)silyl]oxy-dimethyl-(3-pyrimidin-2-ylsulfanylpropyl)silane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

438.13995 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 439.14723 200.6
[M+Na]+ 461.12917 205.9
[M-H]- 437.13267 200.2
[M+NH4]+ 456.17377 206.7
[M+K]+ 477.10311 198.6
[M+H-H2O]+ 421.13721 190.3
[M+HCOO]- 483.13815 204.7
[M+CH3COO]- 497.15380 221.2
[M+Na-2H]- 459.11462 202.3
[M]+ 438.13940 206.3
[M]- 438.14050 206.3
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