CID 117813

26544-22-9

Structural Information

Molecular Formula
C22H39O3P
SMILES
CC(C)CCCCCOP(OCCCCCC(C)C)OC1=CC=CC=C1
InChI
InChI=1S/C22H39O3P/c1-20(2)14-8-6-12-18-23-26(25-22-16-10-5-11-17-22)24-19-13-7-9-15-21(3)4/h5,10-11,16-17,20-21H,6-9,12-15,18-19H2,1-4H3
InChIKey
GPKQLHLOONCFDY-UHFFFAOYSA-N
Compound name
bis(6-methylheptyl) phenyl phosphite
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1616
Patents

382.26367 Da
Monoisotopic Mass

8.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.27095 207.7
[M+Na]+ 405.25289 208.0
[M-H]- 381.25639 207.5
[M+NH4]+ 400.29749 219.6
[M+K]+ 421.22683 205.8
[M+H-H2O]+ 365.26093 196.7
[M+HCOO]- 427.26187 230.5
[M+CH3COO]- 441.27752 225.5
[M+Na-2H]- 403.23834 200.9
[M]+ 382.26312 216.1
[M]- 382.26422 216.1
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