CID 3069056

Brn 5520640

Structural Information

Molecular Formula
C9H12ClNSSi
SMILES
C[Si]1(NCCS1)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C9H12ClNSSi/c1-13(11-6-7-12-13)9-4-2-8(10)3-5-9/h2-5,11H,6-7H2,1H3
InChIKey
LIARZJZNJIDLJG-UHFFFAOYSA-N
Compound name
2-(4-chlorophenyl)-2-methyl-1,3,2-thiazasilolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.01483 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.02211 145.2
[M+Na]+ 252.00405 154.2
[M-H]- 228.00755 149.4
[M+NH4]+ 247.04865 167.1
[M+K]+ 267.97799 148.7
[M+H-H2O]+ 212.01209 140.1
[M+HCOO]- 274.01303 156.4
[M+CH3COO]- 288.02868 157.7
[M+Na-2H]- 249.98950 147.1
[M]+ 229.01428 144.5
[M]- 229.01538 144.5
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

No patent data available for this compound.