CID 116687

Einecs 274-852-9

Structural Information

Molecular Formula
C17H25O3P
SMILES
COP(OCC1CC2CC1C=C2)OCC3CC4CC3C=C4
InChI
InChI=1S/C17H25O3P/c1-18-21(19-10-16-8-12-2-4-14(16)6-12)20-11-17-9-13-3-5-15(17)7-13/h2-5,12-17H,6-11H2,1H3
InChIKey
GRHMZHVDKFWUNS-UHFFFAOYSA-N
Compound name
bis(2-bicyclo[2.2.1]hept-5-enylmethyl) methyl phosphite
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

308.15414 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.16142 178.7
[M+Na]+ 331.14336 182.5
[M-H]- 307.14686 182.8
[M+NH4]+ 326.18796 203.3
[M+K]+ 347.11730 180.8
[M+H-H2O]+ 291.15140 172.8
[M+HCOO]- 353.15234 202.5
[M+CH3COO]- 367.16799 207.4
[M+Na-2H]- 329.12881 172.3
[M]+ 308.15359 182.7
[M]- 308.15469 182.7
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