CID 85595

Tris(nonylphenyl) phosphite

Structural Information

Molecular Formula
C45H69O3P
SMILES
CCCCCCCCCC1=CC=CC=C1OP(OC2=CC=CC=C2CCCCCCCCC)OC3=CC=CC=C3CCCCCCCCC
InChI
InChI=1S/C45H69O3P/c1-4-7-10-13-16-19-22-31-40-34-25-28-37-43(40)46-49(47-44-38-29-26-35-41(44)32-23-20-17-14-11-8-5-2)48-45-39-30-27-36-42(45)33-24-21-18-15-12-9-6-3/h25-30,34-39H,4-24,31-33H2,1-3H3
InChIKey
WGKLOLBTFWFKOD-UHFFFAOYSA-N
Compound name
tris(2-nonylphenyl) phosphite
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

42663
Patents

688.4984 Da
Monoisotopic Mass

19.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 689.50568 290.8
[M+Na]+ 711.48762 301.4
[M+NH4]+ 706.53222 294.7
[M+K]+ 727.46156 287.0
[M-H]- 687.49112 296.4
[M+Na-2H]- 709.47307 294.8
[M]+ 688.49785 294.0
[M]- 688.49895 294.0
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