CID 54422902

1841435-42-4

Structural Information

Molecular Formula

C₁₃H₂₃NOSi

SMILES

CC1=CC(=C(C=C1)O[Si](C)(C)C(C)(C)C)N

InChI

InChI=1S/C13H23NOSi/c1-10-7-8-12(11(14)9-10)15-16(5,6)13(2,3)4/h7-9H,14H2,1-6H3

InChIKey

WCATVLPEPQRASK-UHFFFAOYSA-N

Compound name

2-[tert-butyl(dimethyl)silyl]oxy-5-methylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 237.15489 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]+	238.162166	155.4
[M+Na]+	260.144108	162.6
[M-H]-	236.147614	158.8
[M+NH4]+	255.188713	174.1
[M+K]+	276.118048	160.6
[M+H-H2O]+	220.152150	150.1
[M+HCOO]-	282.153091	175.7
[M+CH3COO]-	296.168741	195.3
[M+Na-2H]-	258.129556	160.2
[M]+	237.15434142	156.5
[M]-	237.15543858	156.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe