CID 375212

Nsc654609

Structural Information

Molecular Formula
C24H21NSSn
SMILES
C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)SC4=CC=CC=C4N
InChI
InChI=1S/C6H7NS.3C6H5.Sn/c7-5-3-1-2-4-6(5)8;3*1-2-4-6-5-3-1;/h1-4,8H,7H2;3*1-5H;/q;;;;+1/p-1
InChIKey
PRRXJWSOJXNNEY-UHFFFAOYSA-M
Compound name
2-triphenylstannylsulfanylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

475.0417 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 476.04898 207.0
[M+Na]+ 498.03092 211.7
[M-H]- 474.03442 217.2
[M+NH4]+ 493.07552 216.9
[M+K]+ 514.00486 202.8
[M+H-H2O]+ 458.03896 195.8
[M+HCOO]- 520.03990 222.9
[M+CH3COO]- 534.05555 214.7
[M+Na-2H]- 496.01637 209.1
[M]+ 475.04115 204.6
[M]- 475.04225 204.6
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.