CID 3054604

1,1-bis(trimethylsilyl)-3-(o-chlorophenyl)-2-thiourea

Structural Information

Molecular Formula
C13H23ClN2SSi2
SMILES
C[Si](C)(C)N(C(=S)NC1=CC=CC=C1Cl)[Si](C)(C)C
InChI
InChI=1S/C13H23ClN2SSi2/c1-18(2,3)16(19(4,5)6)13(17)15-12-10-8-7-9-11(12)14/h7-10H,1-6H3,(H,15,17)
InChIKey
UBNVDSQMONJSGK-UHFFFAOYSA-N
Compound name
3-(2-chlorophenyl)-1,1-bis(trimethylsilyl)thiourea
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

330.0809 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.08818 174.2
[M+Na]+ 353.07012 179.8
[M-H]- 329.07362 178.8
[M+NH4]+ 348.11472 191.1
[M+K]+ 369.04406 175.6
[M+H-H2O]+ 313.07816 168.2
[M+HCOO]- 375.07910 185.2
[M+CH3COO]- 389.09475 210.8
[M+Na-2H]- 351.05557 175.2
[M]+ 330.08035 177.9
[M]- 330.08145 177.9
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

No patent data available for this compound.