CID 42950

59096-06-9

Structural Information

Molecular Formula

C₁₂H₁₉NO₂Si

SMILES

CCOC(=O)C1=CC=C(C=C1)N[Si](C)(C)C

InChI

InChI=1S/C12H19NO2Si/c1-5-15-12(14)10-6-8-11(9-7-10)13-16(2,3)4/h6-9,13H,5H2,1-4H3

InChIKey

MBUKPTCGZZRZQR-UHFFFAOYSA-N

Compound name

ethyl 4-(trimethylsilylamino)benzoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 237.1185 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]+	238.12578	153.6
[M+Na]+	260.10772	164.3
[M+NH4]+	255.15232	160.9
[M+K]+	276.08166	158.8
[M-H]-	236.11122	155.0
[M+Na-2H]-	258.09317	159.2
[M]+	237.11795	155.4
[M]-	237.11905	155.4

Literature stripe

literature stripe

Patent stripe

patents stripe