CID 3470663

Dipotassium tris(1,2-benzenediolato-o,o')silicate

Structural Information

Molecular Formula
C18H12O6Si
SMILES
C1=CC=C2C(=C1)O[Si-2]34(O2)(OC5=CC=CC=C5O3)OC6=CC=CC=C6O4
InChI
InChI=1S/C18H12O6Si/c1-2-8-14-13(7-1)19-25(20-14,21-15-9-3-4-10-16(15)22-25)23-17-11-5-6-12-18(17)24-25/h1-12H/q-2
InChIKey
JIICOOGKGWBPSB-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

352.0403 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.04758 158.4
[M+Na]+ 375.02952 166.7
[M-H]- 351.03302 172.1
[M+NH4]+ 370.07412 171.3
[M+K]+ 391.00346 170.0
[M+H-H2O]+ 335.03756 159.9
[M+HCOO]- 397.03850 173.5
[M+CH3COO]- 411.05415 171.4
[M+Na-2H]- 373.01497 164.0
[M]+ 352.03975 162.0
[M]- 352.04085 162.0
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.