CID 140936489

4-[(tert-butyldimethylsilyl)oxy]-3-fluoroaniline

Structural Information

Molecular Formula

C₁₂H₂₀FNOSi

SMILES

CC(C)(C)[Si](C)(C)OC1=C(C=C(C=C1)N)F

InChI

InChI=1S/C12H20FNOSi/c1-12(2,3)16(4,5)15-11-7-6-9(14)8-10(11)13/h6-8H,14H2,1-5H3

InChIKey

XCZDDYDLXRFXLF-UHFFFAOYSA-N

Compound name

4-[tert-butyl(dimethyl)silyl]oxy-3-fluoroaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 241.12982 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]+	242.137096	153.9
[M+Na]+	264.119038	161.6
[M-H]-	240.122544	156.1
[M+NH4]+	259.163643	172.3
[M+K]+	280.092978	159.3
[M+H-H2O]+	224.127080	147.7
[M+HCOO]-	286.128021	173.4
[M+CH3COO]-	300.143671	195.0
[M+Na-2H]-	262.104486	158.6
[M]+	241.12927142	153.4
[M]-	241.13036858	153.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe