CID 16683979

7360-44-3

Structural Information

Molecular Formula
C2H3AlO2
SMILES
CC(=O)O[Al]
InChI
InChI=1S/C2H4O2.Al/c1-2(3)4;/h1H3,(H,3,4);/q;+1/p-1
InChIKey
DHOORWRMZOLIGC-UHFFFAOYSA-M
Compound name
None
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

676
Patents

85.99484 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 87.002116 110.5
[M+Na]+ 108.98406 119.1
[M-H]- 84.987564 111.4
[M+NH4]+ 104.02866 135.0
[M+K]+ 124.95800 120.6
[M+H-H2O]+ 68.992100 106.7
[M+HCOO]- 130.99304 135.0
[M+CH3COO]- 145.00869 161.3
[M+Na-2H]- 106.96951 118.0
[M]+ 85.994291 112.2
[M]- 85.995389 112.2
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