CID 16684066

56095-74-0

Structural Information

Molecular Formula
C20H41Al
SMILES
CCCCCC/C=C\[Al](CCCCCC)CCCCCC
InChI
InChI=1S/C8H15.2C6H13.Al/c1-3-5-7-8-6-4-2;2*1-3-5-6-4-2;/h1,3H,4-8H2,2H3;2*1,3-6H2,2H3;
InChIKey
KQDXBDSBTFZXIN-UHFFFAOYSA-N
Compound name
dihexyl-[(Z)-oct-1-enyl]alumane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

308.30237 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.30965 187.8
[M+Na]+ 331.29159 189.0
[M-H]- 307.29509 185.4
[M+NH4]+ 326.33619 203.5
[M+K]+ 347.26553 184.6
[M+H-H2O]+ 291.29963 180.8
[M+HCOO]- 353.30057 205.8
[M+CH3COO]- 367.31622 211.9
[M+Na-2H]- 329.27704 185.5
[M]+ 308.30182 193.4
[M]- 308.30292 193.4
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.