CID 57418214

(2z,6e)-3,7,11,15,19-pentamethyl-2,6-eicosadien-1-ol

Structural Information

Molecular Formula
C25H48O
SMILES
CC(C)CCCC(C)CCCC(C)CCC/C(=C/CC/C(=C/CO)/C)/C
InChI
InChI=1S/C25H48O/c1-21(2)11-7-12-22(3)13-8-14-23(4)15-9-16-24(5)17-10-18-25(6)19-20-26/h17,19,21-23,26H,7-16,18,20H2,1-6H3/b24-17+,25-19+
InChIKey
QVAALZYWZYXTTP-OCQYTUGVSA-N
Compound name
(2E,6E)-3,7,11,15,19-pentamethylicosa-2,6-dien-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

364.3705 Da
Monoisotopic Mass

10.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.37778 207.6
[M+Na]+ 387.35972 206.3
[M-H]- 363.36322 203.4
[M+NH4]+ 382.40432 219.5
[M+K]+ 403.33366 201.8
[M+H-H2O]+ 347.36776 200.7
[M+HCOO]- 409.36870 219.3
[M+CH3COO]- 423.38435 224.4
[M+Na-2H]- 385.34517 197.8
[M]+ 364.36995 210.8
[M]- 364.37105 210.8
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

No patent data available for this compound.