CID 24847317

Triethylamine, 2,2'-dichloro-2''-methoxy-, n-oxide, hydrochloride

Structural Information

Molecular Formula
C7H15Cl2NO2
SMILES
COCC[N+](CCCl)(CCCl)[O-]
InChI
InChI=1S/C7H15Cl2NO2/c1-12-7-6-10(11,4-2-8)5-3-9/h2-7H2,1H3
InChIKey
CSJFZWDHWNSGIU-UHFFFAOYSA-N
Compound name
N,N-bis(2-chloroethyl)-2-methoxyethanamine oxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.04799 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.05527 142.9
[M+Na]+ 238.03721 155.3
[M+NH4]+ 233.08181 151.6
[M+K]+ 254.01115 150.2
[M-H]- 214.04071 143.8
[M+Na-2H]- 236.02266 147.3
[M]+ 215.04744 145.5
[M]- 215.04854 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.