CID 73556646

Szfxlvwxfdhtlt-uhfffaoysa-n

Structural Information

Molecular Formula
C33H69BO18
SMILES
B(OCCOCCOCCOCCOCCOC)(OCCOCCOCCOCCOCCOC)OCCOCCOCCOCCOCCOC
InChI
InChI=1S/C33H69BO18/c1-35-4-7-38-10-13-41-16-19-44-22-25-47-28-31-50-34(51-32-29-48-26-23-45-20-17-42-14-11-39-8-5-36-2)52-33-30-49-27-24-46-21-18-43-15-12-40-9-6-37-3/h4-33H2,1-3H3
InChIKey
SZFXLVWXFDHTLT-UHFFFAOYSA-N
Compound name
tris[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethyl] borate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

764.4577 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 765.46498 306.7
[M+Na]+ 787.44692 303.2
[M-H]- 763.45042 297.2
[M+NH4]+ 782.49152 316.5
[M+K]+ 803.42086 302.3
[M+H-H2O]+ 747.45496 308.2
[M+HCOO]- 809.45590 312.5
[M+CH3COO]- 823.47155 278.5
[M+Na-2H]- 785.43237 283.4
[M]+ 764.45715 313.2
[M]- 764.45825 313.2
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.