CID 22630279

Triisotridecyl phosphite

Structural Information

Molecular Formula
C39H81O3P
SMILES
CC(C)CCCCCCCCCCOP(OCCCCCCCCCCC(C)C)OCCCCCCCCCCC(C)C
InChI
InChI=1S/C39H81O3P/c1-37(2)31-25-19-13-7-10-16-22-28-34-40-43(41-35-29-23-17-11-8-14-20-26-32-38(3)4)42-36-30-24-18-12-9-15-21-27-33-39(5)6/h37-39H,7-36H2,1-6H3
InChIKey
IVINYWARLXOTLP-UHFFFAOYSA-N
Compound name
tris(11-methyldodecyl) phosphite
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

221
Patents

628.59235 Da
Monoisotopic Mass

17.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 629.59963 272.2
[M+Na]+ 651.58157 276.3
[M-H]- 627.58507 254.7
[M+NH4]+ 646.62617 276.0
[M+K]+ 667.55551 280.1
[M+H-H2O]+ 611.58961 266.3
[M+HCOO]- 673.59055 270.5
[M+CH3COO]- 687.60620 278.6
[M+Na-2H]- 649.56702 252.8
[M]+ 628.59180 270.4
[M]- 628.59290 270.4
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

patents stripe