CID 16684204

Stannane, acetoxytris(beta,beta-dimethylphenethyl)-

Structural Information

Molecular Formula
C32H42O2Sn
SMILES
CC(=O)O[Sn](CC(C)(C)C1=CC=CC=C1)(CC(C)(C)C2=CC=CC=C2)CC(C)(C)C3=CC=CC=C3
InChI
InChI=1S/3C10H13.C2H4O2.Sn/c3*1-10(2,3)9-7-5-4-6-8-9;1-2(3)4;/h3*4-8H,1H2,2-3H3;1H3,(H,3,4);/q;;;;+1/p-1
InChIKey
VVMWMWOBAUFBPU-UHFFFAOYSA-M
Compound name
tris(2-methyl-2-phenylpropyl)stannyl acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

578.2207 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 579.22798 239.8
[M+Na]+ 601.20992 239.7
[M-H]- 577.21342 246.3
[M+NH4]+ 596.25452 245.5
[M+K]+ 617.18386 234.4
[M+H-H2O]+ 561.21796 228.7
[M+HCOO]- 623.21890 250.6
[M+CH3COO]- 637.23455 243.1
[M+Na-2H]- 599.19537 241.1
[M]+ 578.22015 241.7
[M]- 578.22125 241.7
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