CID 3841099

18246-23-6

Structural Information

Molecular Formula
C8H12O2SSi
SMILES
C[Si](C)(C)C1=CC=C(S1)C(=O)O
InChI
InChI=1S/C8H12O2SSi/c1-12(2,3)7-5-4-6(11-7)8(9)10/h4-5H,1-3H3,(H,9,10)
InChIKey
APCJEUAHYFIVKA-UHFFFAOYSA-N
Compound name
5-trimethylsilylthiophene-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

200.03273 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.04001 142.1
[M+Na]+ 223.02195 150.4
[M-H]- 199.02545 145.0
[M+NH4]+ 218.06655 163.8
[M+K]+ 238.99589 148.2
[M+H-H2O]+ 183.02999 137.6
[M+HCOO]- 245.03093 158.5
[M+CH3COO]- 259.04658 178.2
[M+Na-2H]- 221.00740 143.0
[M]+ 200.03218 144.5
[M]- 200.03328 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

patents stripe