CID 11768960

13529-06-1

Structural Information

Molecular Formula

C₈H₁₂O₂Si

SMILES

C[Si](C)(C)C1=CC=C(O1)C=O

InChI

InChI=1S/C8H12O2Si/c1-11(2,3)8-5-4-7(6-9)10-8/h4-6H,1-3H3

InChIKey

PJVWOEGYTXLMEZ-UHFFFAOYSA-N

Compound name

5-trimethylsilylfuran-2-carbaldehyde

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 168.06065 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]+	169.06793	131.9
[M+Na]+	191.04987	141.0
[M-H]-	167.05337	136.6
[M+NH4]+	186.09447	154.0
[M+K]+	207.02381	141.0
[M+H-H2O]+	151.05791	127.7
[M+HCOO]-	213.05885	155.3
[M+CH3COO]-	227.07450	176.1
[M+Na-2H]-	189.03532	139.0
[M]+	168.06010	135.3
[M]-	168.06120	135.3

Literature stripe

literature stripe

Patent stripe

patents stripe