CID 25244492

Dihydrogeranylgeranyl diphosphate

Structural Information

Molecular Formula
C20H38O7P2
SMILES
CC(CCC/C(=C/COP(=O)(O)OP(=O)(O)O)/C)CC/C=C(\C)/CCC=C(C)C
InChI
InChI=1S/C20H38O7P2/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-26-29(24,25)27-28(21,22)23/h9,11,15,19H,6-8,10,12-14,16H2,1-5H3,(H,24,25)(H2,21,22,23)/b18-11+,20-15+
InChIKey
YJGANOFPASCZBK-VPMBNJIQSA-N
Compound name
phosphono [(2E,10E)-3,7,11,15-tetramethylhexadeca-2,10,14-trienyl] hydrogen phosphate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

452.2093 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 453.21658 202.0
[M+Na]+ 475.19852 205.8
[M-H]- 451.20202 201.1
[M+NH4]+ 470.24312 207.4
[M+K]+ 491.17246 201.6
[M+H-H2O]+ 435.20656 185.4
[M+HCOO]- 497.20750 208.9
[M+CH3COO]- 511.22315 227.0
[M+Na-2H]- 473.18397 188.0
[M]+ 452.20875 198.3
[M]- 452.20985 198.3
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

No patent data available for this compound.