CID 103159

65087-01-6

Structural Information

Molecular Formula
C34H71O8P
SMILES
CCCCCCCCCCCCCOCCOCCOP(=O)(O)OCCOCCOCCCCCCCCCCCCC
InChI
InChI=1S/C34H71O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-37-27-29-39-31-33-41-43(35,36)42-34-32-40-30-28-38-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-34H2,1-2H3,(H,35,36)
InChIKey
FGSBZAZJWFNVCX-UHFFFAOYSA-N
Compound name
bis[2-(2-tridecoxyethoxy)ethyl] hydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

638.48865 Da
Monoisotopic Mass

10.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 639.49593 264.6
[M+Na]+ 661.47787 264.3
[M+NH4]+ 656.52247 267.0
[M+K]+ 677.45181 264.4
[M-H]- 637.48137 248.1
[M+Na-2H]- 659.46332 262.7
[M]+ 638.48810 260.6
[M]- 638.48920 260.6
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.