CID 2763269

Tert-butyl n-[5-(tributylstannyl)-1,3-thiazol-2-yl]carbamate

Structural Information

Molecular Formula
C20H38N2O2SSn
SMILES
CCCC[Sn](CCCC)(CCCC)C1=CN=C(S1)NC(=O)OC(C)(C)C
InChI
InChI=1S/C8H11N2O2S.3C4H9.Sn/c1-8(2,3)12-7(11)10-6-9-4-5-13-6;3*1-3-4-2;/h4H,1-3H3,(H,9,10,11);3*1,3-4H2,2H3;
InChIKey
WBQYLGCBVADFPD-UHFFFAOYSA-N
Compound name
tert-butyl N-(5-tributylstannyl-1,3-thiazol-2-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

143
Patents

490.1676 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 491.17488 222.1
[M+Na]+ 513.15682 224.4
[M-H]- 489.16032 222.3
[M+NH4]+ 508.20142 234.1
[M+K]+ 529.13076 220.1
[M+H-H2O]+ 473.16486 213.6
[M+HCOO]- 535.16580 233.3
[M+CH3COO]- 549.18145 226.2
[M+Na-2H]- 511.14227 217.5
[M]+ 490.16705 229.7
[M]- 490.16815 229.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe