CID 16684131

Aluminum, oxo(2-propanolato)-

Structural Information

Molecular Formula
C3H7AlO2
SMILES
CC(C)O[Al]=O
InChI
InChI=1S/C3H7O.Al.O/c1-3(2)4;;/h3H,1-2H3;;/q-1;+1;
InChIKey
HRUQNUFHAHTISK-UHFFFAOYSA-N
Compound name
oxo(propan-2-yloxy)alumane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

133
Patents

102.026146 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 103.03342 115.5
[M+Na]+ 125.01536 123.6
[M-H]- 101.01887 116.2
[M+NH4]+ 120.05997 139.3
[M+K]+ 140.98930 124.8
[M+H-H2O]+ 85.023406 111.5
[M+HCOO]- 147.02435 139.6
[M+CH3COO]- 161.04000 165.1
[M+Na-2H]- 123.00081 122.4
[M]+ 102.02560 117.6
[M]- 102.02669 117.6
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

patents stripe