CID 136212895

2088828-95-7

Structural Information

Molecular Formula
C11H14FNO2SSi
SMILES
C[Si](C)(C)C#CC1=C(C=CC(=C1)N)S(=O)(=O)F
InChI
InChI=1S/C11H14FNO2SSi/c1-17(2,3)7-6-9-8-10(13)4-5-11(9)16(12,14)15/h4-5,8H,13H2,1-3H3
InChIKey
LAFAMHANYOALCO-UHFFFAOYSA-N
Compound name
4-amino-2-(2-trimethylsilylethynyl)benzenesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

271.04987 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.05715 166.9
[M+Na]+ 294.03909 177.3
[M-H]- 270.04259 168.2
[M+NH4]+ 289.08369 182.3
[M+K]+ 310.01303 173.1
[M+H-H2O]+ 254.04713 154.6
[M+HCOO]- 316.04807 176.8
[M+CH3COO]- 330.06372 200.5
[M+Na-2H]- 292.02454 167.5
[M]+ 271.04932 161.8
[M]- 271.05042 161.8
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.