CID 20265939

4-dodecylstyrene

Structural Information

Molecular Formula
C20H32
SMILES
CCCCCCCCCCCCC1=CC=C(C=C1)C=C
InChI
InChI=1S/C20H32/c1-3-5-6-7-8-9-10-11-12-13-14-20-17-15-19(4-2)16-18-20/h4,15-18H,2-3,5-14H2,1H3
InChIKey
WJNKJKGZKFOLOJ-UHFFFAOYSA-N
Compound name
1-dodecyl-4-ethenylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9962
Patents

272.2504 Da
Monoisotopic Mass

8.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.25768 172.8
[M+Na]+ 295.23962 185.1
[M+NH4]+ 290.28422 181.0
[M+K]+ 311.21356 174.4
[M-H]- 271.24312 175.7
[M+Na-2H]- 293.22507 178.4
[M]+ 272.24985 175.4
[M]- 272.25095 175.4
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