CID 16682951

Trihexylalumane

Structural Information

Molecular Formula
C18H39Al
SMILES
CCCCCC[Al](CCCCCC)CCCCCC
InChI
InChI=1S/3C6H13.Al/c3*1-3-5-6-4-2;/h3*1,3-6H2,2H3;
InChIKey
ORYGRKHDLWYTKX-UHFFFAOYSA-N
Compound name
trihexylalumane
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

0
References

36476
Patents

282.2867 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.29398 180.4
[M+Na]+ 305.27592 182.0
[M-H]- 281.27942 178.3
[M+NH4]+ 300.32052 197.2
[M+K]+ 321.24986 178.8
[M+H-H2O]+ 265.28396 173.7
[M+HCOO]- 327.28490 198.8
[M+CH3COO]- 341.30055 207.5
[M+Na-2H]- 303.26137 179.1
[M]+ 282.28615 186.0
[M]- 282.28725 186.0
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.