CID 16683179

Nsc633514

Structural Information

Molecular Formula
C12H26N2O4Sn
SMILES
CCCC[Sn](CCCC)(OC(=O)CN)OC(=O)CN
InChI
InChI=1S/2C4H9.2C2H5NO2.Sn/c2*1-3-4-2;2*3-1-2(4)5;/h2*1,3-4H2,2H3;2*1,3H2,(H,4,5);/q;;;;+2/p-2
InChIKey
GRBLPHJTEPRUFT-UHFFFAOYSA-L
Compound name
[(2-aminoacetyl)oxy-dibutylstannyl] 2-aminoacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

382.09146 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.09874 189.1
[M+Na]+ 405.08068 191.3
[M-H]- 381.08418 186.5
[M+NH4]+ 400.12528 203.0
[M+K]+ 421.05462 190.2
[M+H-H2O]+ 365.08872 181.5
[M+HCOO]- 427.08966 208.0
[M+CH3COO]- 441.10531 208.0
[M+Na-2H]- 403.06613 187.2
[M]+ 382.09091 191.8
[M]- 382.09201 191.8
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.