CID 69638

686-10-2

Structural Information

Molecular Formula
C6H10Cl3N
SMILES
CCN(CC)C(=C(Cl)Cl)Cl
InChI
InChI=1S/C6H10Cl3N/c1-3-10(4-2)6(9)5(7)8/h3-4H2,1-2H3
InChIKey
DVSJBCFGNHBBKG-UHFFFAOYSA-N
Compound name
1,2,2-trichloro-N,N-diethylethenamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

124
Patents

200.98788 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.99516 140.0
[M+Na]+ 223.97710 147.5
[M-H]- 199.98060 140.0
[M+NH4]+ 219.02170 160.6
[M+K]+ 239.95104 143.6
[M+H-H2O]+ 183.98514 137.8
[M+HCOO]- 245.98608 148.6
[M+CH3COO]- 260.00173 189.8
[M+Na-2H]- 221.96255 141.8
[M]+ 200.98733 142.3
[M]- 200.98843 142.3
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.