CID 16683979

7360-44-3

Structural Information

Molecular Formula

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

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	87.002116	111.4
[M+Na]+	108.98406	122.4
[M+NH4]+	104.02866	119.8
[M+K]+	124.95800	117.9
[M-H]-	84.987564	110.7
[M+Na-2H]-	106.96951	115.9
[M]+	85.994291	112.5
[M]-	85.995389	112.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe