CID 16683181

Nsc633516

Structural Information

Molecular Formula
C18H30N2O6Sn
SMILES
CCCC[Sn](CCCC)(OC(=O)C1CCC(=O)N1)OC(=O)C2CCC(=O)N2
InChI
InChI=1S/2C5H7NO3.2C4H9.Sn/c2*7-4-2-1-3(6-4)5(8)9;2*1-3-4-2;/h2*3H,1-2H2,(H,6,7)(H,8,9);2*1,3-4H2,2H3;/q;;;;+2/p-2
InChIKey
MPDSKQBYIDMGJJ-UHFFFAOYSA-L
Compound name
[dibutyl-(5-oxopyrrolidine-2-carbonyl)oxystannyl] 5-oxopyrrolidine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

490.11258 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 491.11986 213.3
[M+Na]+ 513.10180 213.4
[M-H]- 489.10530 212.2
[M+NH4]+ 508.14640 222.5
[M+K]+ 529.07574 210.4
[M+H-H2O]+ 473.10984 205.0
[M+HCOO]- 535.11078 223.2
[M+CH3COO]- 549.12643 215.3
[M+Na-2H]- 511.08725 205.5
[M]+ 490.11203 211.9
[M]- 490.11313 211.9
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.