CID 81645

Triphenyl tin thiocyanate

Structural Information

Molecular Formula

C₁₉H₁₅NSSn

SMILES

C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)SC#N

InChI

InChI=1S/3C6H5.CHNS.Sn/c3*1-2-4-6-5-3-1;2-1-3;/h3*1-5H;3H;/q;;;;+1/p-1

InChIKey

KKSYJIQZLYKVDK-UHFFFAOYSA-M

Compound name

triphenylstannyl thiocyanate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 408.99472 Da
Monoisotopic Mass: None
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	410.00200	201.2
[M+Na]+	431.98394	210.1
[M-H]-	407.98744	207.9
[M+NH4]+	427.02854	213.4
[M+K]+	447.95788	200.7
[M+H-H2O]+	391.99198	185.5
[M+HCOO]-	453.99292	213.8
[M+CH3COO]-	468.00857	208.8
[M+Na-2H]-	429.96939	202.7
[M]+	408.99417	195.8
[M]-	408.99527	195.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe