CID 82006423

2-(2,2-difluoroethoxy)-1,1-diethoxyethane

Structural Information

Molecular Formula
C8H16F2O3
SMILES
CCOC(COCC(F)F)OCC
InChI
InChI=1S/C8H16F2O3/c1-3-12-8(13-4-2)6-11-5-7(9)10/h7-8H,3-6H2,1-2H3
InChIKey
ZMNYKTFKKMTHKH-UHFFFAOYSA-N
Compound name
2-(2,2-difluoroethoxy)-1,1-diethoxyethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.10675 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.11403 142.8
[M+Na]+ 221.09597 148.7
[M-H]- 197.09947 139.9
[M+NH4]+ 216.14057 162.0
[M+K]+ 237.06991 149.5
[M+H-H2O]+ 181.10401 135.7
[M+HCOO]- 243.10495 162.6
[M+CH3COO]- 257.12060 186.3
[M+Na-2H]- 219.08142 145.1
[M]+ 198.10620 145.5
[M]- 198.10730 145.5
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.