CID 6453063

54729-80-5

Structural Information

Molecular Formula

C₁₁H₂₇NO₃Si

SMILES

CCCCNC[Si](OCC)(OCC)OCC

InChI

InChI=1S/C11H27NO3Si/c1-5-9-10-12-11-16(13-6-2,14-7-3)15-8-4/h12H,5-11H2,1-4H3

InChIKey

NUIHYBYNCRBAJK-UHFFFAOYSA-N

Compound name

N-(triethoxysilylmethyl)butan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 239
Patents: 249.17603 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]+	250.183306	161.2
[M+Na]+	272.165248	165.3
[M-H]-	248.168754	160.4
[M+NH4]+	267.209853	179.0
[M+K]+	288.139188	165.3
[M+H-H2O]+	232.173290	155.2
[M+HCOO]-	294.174231	183.1
[M+CH3COO]-	308.189881	196.6
[M+Na-2H]-	270.150696	165.9
[M]+	249.17548142	167.9
[M]-	249.17657858	167.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe