CID 3051637

67590-56-1

Structural Information

Molecular Formula
C6H11AsO3
SMILES
CCC12CO[As](OC1)OC2
InChI
InChI=1S/C6H11AsO3/c1-2-6-3-8-7(9-4-6)10-5-6/h2-5H2,1H3
InChIKey
FLTCWLUFYQIHJS-UHFFFAOYSA-N
Compound name
4-ethyl-2,6,7-trioxa-1-arsabicyclo[2.2.2]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.99242 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.99970 134.1
[M+Na]+ 228.98164 139.1
[M-H]- 204.98514 132.8
[M+NH4]+ 224.02624 157.3
[M+K]+ 244.95558 141.9
[M+H-H2O]+ 188.98968 129.1
[M+HCOO]- 250.99062 144.2
[M+CH3COO]- 265.00627 145.8
[M+Na-2H]- 226.96709 149.4
[M]+ 205.99187 138.5
[M]- 205.99297 138.5
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

No patent data available for this compound.