CID 5281365

Geranylgeraniol

Structural Information

Molecular Formula
C20H34O
SMILES
CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CO)/C)/C)/C)C
InChI
InChI=1S/C20H34O/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h9,11,13,15,21H,6-8,10,12,14,16H2,1-5H3/b18-11+,19-13+,20-15+
InChIKey
OJISWRZIEWCUBN-QIRCYJPOSA-N
Compound name
(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-ol
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

275
References

3447
Patents

290.26096 Da
Monoisotopic Mass

6.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.26824 181.7
[M+Na]+ 313.25018 183.4
[M-H]- 289.25368 178.6
[M+NH4]+ 308.29478 196.7
[M+K]+ 329.22412 178.5
[M+H-H2O]+ 273.25822 175.9
[M+HCOO]- 335.25916 196.5
[M+CH3COO]- 349.27481 205.8
[M+Na-2H]- 311.23563 175.9
[M]+ 290.26041 182.1
[M]- 290.26151 182.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe