CID 113140

63217-12-9

Structural Information

Molecular Formula
C14H31O8P
SMILES
CCCCCCOCCOCCOCCOCCOP(=O)(O)O
InChI
InChI=1S/C14H31O8P/c1-2-3-4-5-6-18-7-8-19-9-10-20-11-12-21-13-14-22-23(15,16)17/h2-14H2,1H3,(H2,15,16,17)
InChIKey
ZCJFTNUEUAISRV-UHFFFAOYSA-N
Compound name
2-[2-[2-(2-hexoxyethoxy)ethoxy]ethoxy]ethyl dihydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

358.17566 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.18294 184.5
[M+Na]+ 381.16488 188.3
[M+NH4]+ 376.20948 197.1
[M+K]+ 397.13882 192.7
[M-H]- 357.16838 185.2
[M+Na-2H]- 379.15033 181.6
[M]+ 358.17511 182.4
[M]- 358.17621 182.4
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