CID 59693891

3-methyl-5-(tributylstannyl)-1,2,4-thiadiazole

Structural Information

Molecular Formula
C15H30N2SSn
SMILES
CCCC[Sn](CCCC)(CCCC)C1=NC(=NS1)C
InChI
InChI=1S/3C4H9.C3H3N2S.Sn/c3*1-3-4-2;1-3-4-2-6-5-3;/h3*1,3-4H2,2H3;1H3;
InChIKey
HBOBCVOCFXSYAJ-UHFFFAOYSA-N
Compound name
tributyl-(3-methyl-1,2,4-thiadiazol-5-yl)stannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

26
Patents

390.11517 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.12245 193.4
[M+Na]+ 413.10439 198.8
[M-H]- 389.10789 192.8
[M+NH4]+ 408.14899 208.6
[M+K]+ 429.07833 194.3
[M+H-H2O]+ 373.11243 184.7
[M+HCOO]- 435.11337 206.0
[M+CH3COO]- 449.12902 207.1
[M+Na-2H]- 411.08984 189.9
[M]+ 390.11462 199.8
[M]- 390.11572 199.8
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

patents stripe