CID 59591

2-(n-(2-chloroethyl)-n-(2-chloropropyl)amino)acetamide monohydrochloride

Structural Information

Molecular Formula
C7H14Cl2N2O
SMILES
CC(CN(CCCl)CC(=O)N)Cl
InChI
InChI=1S/C7H14Cl2N2O/c1-6(9)4-11(3-2-8)5-7(10)12/h6H,2-5H2,1H3,(H2,10,12)
InChIKey
QVPDZTDSBXMVOO-UHFFFAOYSA-N
Compound name
2-[2-chloroethyl(2-chloropropyl)amino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.04832 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.05560 144.4
[M+Na]+ 235.03754 153.3
[M+NH4]+ 230.08214 151.8
[M+K]+ 251.01148 148.2
[M-H]- 211.04104 144.2
[M+Na-2H]- 233.02299 147.2
[M]+ 212.04777 145.8
[M]- 212.04887 145.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.