CID 246195

N,n'-(pentane-1,5-diyl)bis(2-chloroacetamide)

Structural Information

Molecular Formula
C9H16Cl2N2O2
SMILES
C(CCNC(=O)CCl)CCNC(=O)CCl
InChI
InChI=1S/C9H16Cl2N2O2/c10-6-8(14)12-4-2-1-3-5-13-9(15)7-11/h1-7H2,(H,12,14)(H,13,15)
InChIKey
YHXXCHVUPKCXGH-UHFFFAOYSA-N
Compound name
2-chloro-N-[5-[(2-chloroacetyl)amino]pentyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

254.05888 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.06616 154.9
[M+Na]+ 277.04810 163.1
[M+NH4]+ 272.09270 161.1
[M+K]+ 293.02204 157.2
[M-H]- 253.05160 153.7
[M+Na-2H]- 275.03355 156.9
[M]+ 254.05833 155.8
[M]- 254.05943 155.8
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

patents stripe