CID 182365

63314-23-8

Structural Information

Molecular Formula
C20H18O2Sn
SMILES
C1=CC=C(C=C1)[Sn](CC(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/3C6H5.C2H3O2.Sn/c3*1-2-4-6-5-3-1;1-2(3)4;/h3*1-5H;1H2,(H,3,4);
InChIKey
XOAROYSBHYQOIE-UHFFFAOYSA-N
Compound name
2-triphenylstannylacetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

410.03287 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 411.040146 192.0
[M+Na]+ 433.022088 195.7
[M-H]- 409.025594 198.6
[M+NH4]+ 428.066693 203.7
[M+K]+ 448.996028 189.7
[M+H-H2O]+ 393.030130 182.0
[M+HCOO]- 455.031071 210.4
[M+CH3COO]- 469.046721 205.0
[M+Na-2H]- 431.007536 195.6
[M]+ 410.03232142 189.7
[M]- 410.03341858 189.7
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