CID 6367255

Diheptadecyl phosphite

Structural Information

Molecular Formula
C34H70O3P
SMILES
CCCCCCCCCCCCCCCCCO[P+](=O)OCCCCCCCCCCCCCCCCC
InChI
InChI=1S/C34H70O3P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-36-38(35)37-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-34H2,1-2H3/q+1
InChIKey
ORFRTSRVIBPNSM-UHFFFAOYSA-N
Compound name
di(heptadecoxy)-oxophosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

557.5063 Da
Monoisotopic Mass

16.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 558.51358 257.9
[M+Na]+ 580.49552 260.5
[M-H]- 556.49902 239.0
[M+NH4]+ 575.54012 256.7
[M+K]+ 596.46946 258.5
[M+H-H2O]+ 540.50356 246.4
[M+HCOO]- 602.50450 269.2
[M+CH3COO]- 616.52015 255.8
[M+Na-2H]- 578.48097 238.5
[M]+ 557.50575 254.1
[M]- 557.50685 254.1
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