CID 90714

Triisooctyl phosphite

Structural Information

Molecular Formula
C24H51O3P
SMILES
CC(C)CCCCCOP(OCCCCCC(C)C)OCCCCCC(C)C
InChI
InChI=1S/C24H51O3P/c1-22(2)16-10-7-13-19-25-28(26-20-14-8-11-17-23(3)4)27-21-15-9-12-18-24(5)6/h22-24H,7-21H2,1-6H3
InChIKey
DECPGQLXYYCNEZ-UHFFFAOYSA-N
Compound name
tris(6-methylheptyl) phosphite
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

3417
Patents

418.35757 Da
Monoisotopic Mass

9.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 419.36485 226.0
[M+Na]+ 441.34679 226.0
[M-H]- 417.35029 207.5
[M+NH4]+ 436.39139 223.4
[M+K]+ 457.32073 222.6
[M+H-H2O]+ 401.35483 215.7
[M+HCOO]- 463.35577 223.5
[M+CH3COO]- 477.37142 236.6
[M+Na-2H]- 439.33224 214.6
[M]+ 418.35702 218.3
[M]- 418.35812 218.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe