CID 11398080

26544-27-4

Structural Information

Molecular Formula
C25H50O6P2
SMILES
CC(C)CCCCCCCOP1OCC2(CO1)COP(OC2)OCCCCCCCC(C)C
InChI
InChI=1S/C25H50O6P2/c1-23(2)15-11-7-5-9-13-17-26-32-28-19-25(20-29-32)21-30-33(31-22-25)27-18-14-10-6-8-12-16-24(3)4/h23-24H,5-22H2,1-4H3
InChIKey
YLUZWKKWWSCRSR-UHFFFAOYSA-N
Compound name
3,9-bis(8-methylnonoxy)-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

8757
Patents

508.30826 Da
Monoisotopic Mass

8.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 509.31554 249.7
[M+Na]+ 531.29748 246.2
[M-H]- 507.30098 251.0
[M+NH4]+ 526.34208 253.4
[M+K]+ 547.27142 248.8
[M+H-H2O]+ 491.30552 236.0
[M+HCOO]- 553.30646 266.5
[M+CH3COO]- 567.32211 246.5
[M+Na-2H]- 529.28293 240.6
[M]+ 508.30771 256.8
[M]- 508.30881 256.8
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