CID 115883

1,2-diethoxy-1,1,2,2-tetrachloroethane

Structural Information

Molecular Formula
C6H10Cl4O2
SMILES
CCOC(C(OCC)(Cl)Cl)(Cl)Cl
InChI
InChI=1S/C6H10Cl4O2/c1-3-11-5(7,8)6(9,10)12-4-2/h3-4H2,1-2H3
InChIKey
YANHWQPKPABZFO-UHFFFAOYSA-N
Compound name
1,1,2,2-tetrachloro-1,2-diethoxyethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

253.9435 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.95078 149.4
[M+Na]+ 276.93272 157.7
[M-H]- 252.93622 147.2
[M+NH4]+ 271.97732 167.2
[M+K]+ 292.90666 153.5
[M+H-H2O]+ 236.94076 148.2
[M+HCOO]- 298.94170 150.0
[M+CH3COO]- 312.95735 192.4
[M+Na-2H]- 274.91817 153.9
[M]+ 253.94295 153.4
[M]- 253.94405 153.4
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.