CID 16684143

Aluminum, ((3z)-3-hepten-1-olato)dipropyl-

Structural Information

Molecular Formula
C13H27AlO
SMILES
CCC/C=C\CCO[Al](CCC)CCC
InChI
InChI=1S/C7H13O.2C3H7.Al/c1-2-3-4-5-6-7-8;2*1-3-2;/h4-5H,2-3,6-7H2,1H3;2*1,3H2,2H3;/q-1;;;+1/b5-4-;;;
InChIKey
DJOIUHFBEYDHAN-OAWHIZORSA-N
Compound name
[(Z)-hept-3-enoxy]-dipropylalumane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.18773 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.19501 157.5
[M+Na]+ 249.17695 166.7
[M+NH4]+ 244.22155 164.6
[M+K]+ 265.15089 159.0
[M-H]- 225.18045 156.9
[M+Na-2H]- 247.16240 159.5
[M]+ 226.18718 158.4
[M]- 226.18828 158.4
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.