CID 57538

Brn 2359444

Structural Information

Molecular Formula
C6H11Cl3N2O
SMILES
C(CCl)N(CCCl)NC(=O)CCl
InChI
InChI=1S/C6H11Cl3N2O/c7-1-3-11(4-2-8)10-6(12)5-9/h1-5H2,(H,10,12)
InChIKey
GIYHWSNIKVLYAQ-UHFFFAOYSA-N
Compound name
2-chloro-N',N'-bis(2-chloroethyl)acetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.9937 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.00098 148.4
[M+Na]+ 254.98292 155.1
[M-H]- 230.98642 148.1
[M+NH4]+ 250.02752 167.3
[M+K]+ 270.95686 151.3
[M+H-H2O]+ 214.99096 145.4
[M+HCOO]- 276.99190 159.0
[M+CH3COO]- 291.00755 195.3
[M+Na-2H]- 252.96837 151.3
[M]+ 231.99315 151.8
[M]- 231.99425 151.8
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.