CID 81535

Dimethyl pentaerythritol diphosphite

Structural Information

Molecular Formula
C7H14O6P2
SMILES
COP1OCC2(CO1)COP(OC2)OC
InChI
InChI=1S/C7H14O6P2/c1-8-14-10-3-7(4-11-14)5-12-15(9-2)13-6-7/h3-6H2,1-2H3
InChIKey
HOXJPOHBQHBZGL-UHFFFAOYSA-N
Compound name
3,9-dimethoxy-2,4,8,10-tetraoxa-3,9-diphosphaspiro[5.5]undecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

398
Patents

256.02655 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.03383 161.6
[M+Na]+ 279.01577 166.2
[M-H]- 255.01927 166.4
[M+NH4]+ 274.06037 175.8
[M+K]+ 294.98971 172.0
[M+H-H2O]+ 239.02381 151.0
[M+HCOO]- 301.02475 186.7
[M+CH3COO]- 315.04040 192.4
[M+Na-2H]- 277.00122 164.5
[M]+ 256.02600 164.2
[M]- 256.02710 164.2
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