CID 16682954

Dibah

Structural Information

Molecular Formula
C8H18Al
SMILES
CC(C)C[Al]CC(C)C
InChI
InChI=1S/2C4H9.Al/c2*1-4(2)3;/h2*4H,1H2,2-3H3;
InChIKey
SIPUZPBQZHNSDW-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

99873
Patents

141.12239 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.129666 134.3
[M+Na]+ 164.111608 139.8
[M-H]- 140.115114 134.2
[M+NH4]+ 159.156213 156.7
[M+K]+ 180.085548 139.9
[M+H-H2O]+ 124.119650 129.7
[M+HCOO]- 186.120591 155.1
[M+CH3COO]- 200.136241 178.2
[M+Na-2H]- 162.097056 137.3
[M]+ 141.12184142 135.4
[M]- 141.12293858 135.4
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