CID 16124720

721968-86-1

Structural Information

Molecular Formula

C₁₂H₁₇NSi

SMILES

C[Si](C)(C)C#CC1=CC=C(C=C1)CN

InChI

InChI=1S/C12H17NSi/c1-14(2,3)9-8-11-4-6-12(10-13)7-5-11/h4-7H,10,13H2,1-3H3

InChIKey

PRIMLIQJCZQUST-UHFFFAOYSA-N

Compound name

[4-(2-trimethylsilylethynyl)phenyl]methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 203.11302 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]+	204.12030	147.3
[M+Na]+	226.10224	158.8
[M+NH4]+	221.14684	152.2
[M+K]+	242.07618	149.1
[M-H]-	202.10574	141.8
[M+Na-2H]-	224.08769	150.7
[M]+	203.11247	146.6
[M]-	203.11357	146.6

Literature stripe

literature stripe

Patent stripe

patents stripe