CID 165987082

1-methyl-3-(tributylstannyl)-1h-1,2,4-triazole

Structural Information

Molecular Formula
C15H31N3Sn
SMILES
CCCC[Sn](CCCC)(CCCC)C1=NN(C=N1)C
InChI
InChI=1S/3C4H9.C3H4N3.Sn/c3*1-3-4-2;1-6-3-4-2-5-6;/h3*1,3-4H2,2H3;3H,1H3;
InChIKey
SHQOKAMZKKLPRV-UHFFFAOYSA-N
Compound name
tributyl-(1-methyl-1,2,4-triazol-3-yl)stannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

373.154 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.16128 192.6
[M+Na]+ 396.14322 197.5
[M-H]- 372.14672 190.3
[M+NH4]+ 391.18782 206.3
[M+K]+ 412.11716 193.7
[M+H-H2O]+ 356.15126 182.8
[M+HCOO]- 418.15220 208.8
[M+CH3COO]- 432.16785 206.2
[M+Na-2H]- 394.12867 192.3
[M]+ 373.15345 197.2
[M]- 373.15455 197.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.