CID 2763255

3-methyl-5-(tributylstannyl)isoxazole

Structural Information

Molecular Formula
C16H31NOSn
SMILES
CCCC[Sn](CCCC)(CCCC)C1=CC(=NO1)C
InChI
InChI=1S/C4H4NO.3C4H9.Sn/c1-4-2-3-6-5-4;3*1-3-4-2;/h2H,1H3;3*1,3-4H2,2H3;
InChIKey
YYGNJPDQYSBWPH-UHFFFAOYSA-N
Compound name
tributyl-(3-methyl-1,2-oxazol-5-yl)stannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

163
Patents

373.14276 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.15004 185.5
[M+Na]+ 396.13198 195.0
[M+NH4]+ 391.17658 191.8
[M+K]+ 412.10592 189.0
[M-H]- 372.13548 186.7
[M+Na-2H]- 394.11743 187.3
[M]+ 373.14221 187.1
[M]- 373.14331 187.1
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