CID 21867455

1-methyl-5-(tributylstannyl)-1h-pyrazole

Structural Information

Molecular Formula

C₁₆H₃₂N₂Sn

SMILES

CCCC[Sn](CCCC)(CCCC)C1=CC=NN1C

InChI

InChI=1S/C4H5N2.3C4H9.Sn/c1-6-4-2-3-5-6;3*1-3-4-2;/h2-3H,1H3;3*1,3-4H2,2H3;

InChIKey

MEFBHJAGBFBLEH-UHFFFAOYSA-N

Compound name

tributyl-(2-methylpyrazol-3-yl)stannane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 90
Patents: 372.15875 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]+	373.16603	186.7
[M+Na]+	395.14797	196.1
[M+NH4]+	390.19257	192.9
[M+K]+	411.12191	189.5
[M-H]-	371.15147	186.3
[M+Na-2H]-	393.13342	189.0
[M]+	372.15820	187.8
[M]-	372.15930	187.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe