CID 44151765

Einecs 298-795-4

Structural Information

Molecular Formula
C32H67O4P
SMILES
CCCCCCCCCCCCCCCCCCOP(=O)(O)OCCCCCCCCCCCCCC
InChI
InChI=1S/C32H67O4P/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-36-37(33,34)35-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h3-32H2,1-2H3,(H,33,34)
InChIKey
VLFRUSLUCNFIGE-UHFFFAOYSA-N
Compound name
octadecyl tetradecyl hydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

546.4777 Da
Monoisotopic Mass

14.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 547.484976 245.4
[M+Na]+ 569.466918 247.4
[M-H]- 545.470424 227.8
[M+NH4]+ 564.511523 243.2
[M+K]+ 585.440858 247.3
[M+H-H2O]+ 529.474960 235.3
[M+HCOO]- 591.475901 255.9
[M+CH3COO]- 605.491551 255.8
[M+Na-2H]- 567.452366 226.2
[M]+ 546.47715142 243.4
[M]- 546.47824858 243.4
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

No patent data available for this compound.