CID 58631

101651-69-8

Structural Information

Molecular Formula
C14H20Cl2N2OS
SMILES
CCN(CC)CCSCC(=O)NC1=C(C=CC=C1Cl)Cl
InChI
InChI=1S/C14H20Cl2N2OS/c1-3-18(4-2)8-9-20-10-13(19)17-14-11(15)6-5-7-12(14)16/h5-7H,3-4,8-10H2,1-2H3,(H,17,19)
InChIKey
HAUNPEDICOSPOR-UHFFFAOYSA-N
Compound name
N-(2,6-dichlorophenyl)-2-[2-(diethylamino)ethylsulfanyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

334.06735 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.07463 177.3
[M+Na]+ 357.05657 188.4
[M+NH4]+ 352.10117 185.4
[M+K]+ 373.03051 178.5
[M-H]- 333.06007 180.3
[M+Na-2H]- 355.04202 182.1
[M]+ 334.06680 180.7
[M]- 334.06790 180.7
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.