CID 137942556

Tert-butyl 5-(tributylstannyl)-1,2-oxazole-3-carboxylate

Structural Information

Molecular Formula
C20H37NO3Sn
SMILES
CCCC[Sn](CCCC)(CCCC)C1=CC(=NO1)C(=O)OC(C)(C)C
InChI
InChI=1S/C8H10NO3.3C4H9.Sn/c1-8(2,3)12-7(10)6-4-5-11-9-6;3*1-3-4-2;/h4H,1-3H3;3*1,3-4H2,2H3;
InChIKey
BTLRVELTDFJBSZ-UHFFFAOYSA-N
Compound name
tert-butyl 5-tributylstannyl-1,2-oxazole-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

459.17953 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 460.18681 214.8
[M+Na]+ 482.16875 218.0
[M-H]- 458.17225 215.6
[M+NH4]+ 477.21335 226.4
[M+K]+ 498.14269 216.0
[M+H-H2O]+ 442.17679 206.9
[M+HCOO]- 504.17773 229.4
[M+CH3COO]- 518.19338 220.6
[M+Na-2H]- 480.15420 213.3
[M]+ 459.17898 223.2
[M]- 459.18008 223.2
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.