CID 29303

1-hexacosene

Structural Information

Molecular Formula
C26H52
SMILES
CCCCCCCCCCCCCCCCCCCCCCCCC=C
InChI
InChI=1S/C26H52/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-24-22-20-18-16-14-12-10-8-6-4-2/h3H,1,4-26H2,2H3
InChIKey
OMXANELYEWRDAW-UHFFFAOYSA-N
Compound name
hexacos-1-ene
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

3550
Patents

364.4069 Da
Monoisotopic Mass

14.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.414176 206.9
[M+Na]+ 387.396118 206.1
[M-H]- 363.399624 203.3
[M+NH4]+ 382.440723 219.7
[M+K]+ 403.370058 200.0
[M+H-H2O]+ 347.404160 198.9
[M+HCOO]- 409.405101 224.2
[M+CH3COO]- 423.420751 226.6
[M+Na-2H]- 385.381566 203.3
[M]+ 364.40635142 215.1
[M]- 364.40744858 215.1
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