CID 3008672

1,3-benzothiazol-2-ylsulfanyl(trimethyl)stannane

Structural Information

Molecular Formula
C10H13NS2Sn
SMILES
C[Sn](C)(C)SC1=NC2=CC=CC=C2S1
InChI
InChI=1S/C7H5NS2.3CH3.Sn/c9-7-8-5-3-1-2-4-6(5)10-7;;;;/h1-4H,(H,8,9);3*1H3;/q;;;;+1/p-1
InChIKey
TXOJIGYFMPUKLH-UHFFFAOYSA-M
Compound name
1,3-benzothiazol-2-ylsulfanyl(trimethyl)stannane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

330.95114 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 331.95842 166.7
[M+Na]+ 353.94036 177.3
[M-H]- 329.94386 169.9
[M+NH4]+ 348.98496 187.1
[M+K]+ 369.91430 172.1
[M+H-H2O]+ 313.94840 160.7
[M+HCOO]- 375.94934 178.3
[M+CH3COO]- 389.96499 191.2
[M+Na-2H]- 351.92581 167.9
[M]+ 330.95059 172.2
[M]- 330.95169 172.2
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.