CID 11048687

4-bromo-2-(tributylstannyl)-1,3-thiazole

Structural Information

Molecular Formula
C15H28BrNSSn
SMILES
CCCC[Sn](CCCC)(CCCC)C1=NC(=CS1)Br
InChI
InChI=1S/3C4H9.C3HBrNS.Sn/c3*1-3-4-2;4-3-1-6-2-5-3;/h3*1,3-4H2,2H3;1H;
InChIKey
ZBBDCVVDIHDNRL-UHFFFAOYSA-N
Compound name
(4-bromo-1,3-thiazol-2-yl)-tributylstannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

47
Patents

453.0148 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 454.02208 194.4
[M+Na]+ 476.00402 203.8
[M-H]- 452.00752 198.1
[M+NH4]+ 471.04862 212.5
[M+K]+ 491.97796 190.2
[M+H-H2O]+ 436.01206 192.7
[M+HCOO]- 498.01300 206.6
[M+CH3COO]- 512.02865 212.8
[M+Na-2H]- 473.98947 193.0
[M]+ 453.01425 218.5
[M]- 453.01535 218.5
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