CID 18993715

175217-23-9

Structural Information

Molecular Formula

C₁₀H₁₆O₂SSi

SMILES

CC1=C(SC(=C1C(=O)O)[Si](C)(C)C)C

InChI

InChI=1S/C10H16O2SSi/c1-6-7(2)13-10(14(3,4)5)8(6)9(11)12/h1-5H3,(H,11,12)

InChIKey

VTNSLLAJPABUFM-UHFFFAOYSA-N

Compound name

4,5-dimethyl-2-trimethylsilylthiophene-3-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 25
Patents: 228.06403 Da
Monoisotopic Mass: None
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	229.07131	152.1
[M+Na]+	251.05325	161.8
[M+NH4]+	246.09785	159.7
[M+K]+	267.02719	157.2
[M-H]-	227.05675	152.1
[M+Na-2H]-	249.03870	154.4
[M]+	228.06348	153.8
[M]-	228.06458	153.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe