CID 58625

C 5415

Structural Information

Molecular Formula
C13H20ClN3O
SMILES
CN(C)CCN(C)CC(=O)NC1=CC=CC=C1Cl
InChI
InChI=1S/C13H20ClN3O/c1-16(2)8-9-17(3)10-13(18)15-12-7-5-4-6-11(12)14/h4-7H,8-10H2,1-3H3,(H,15,18)
InChIKey
PFCFFZCIUGEMQG-UHFFFAOYSA-N
Compound name
N-(2-chlorophenyl)-2-[2-(dimethylamino)ethyl-methylamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

269.1295 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.13678 164.9
[M+Na]+ 292.11872 170.0
[M-H]- 268.12222 170.7
[M+NH4]+ 287.16332 182.5
[M+K]+ 308.09266 168.2
[M+H-H2O]+ 252.12676 157.8
[M+HCOO]- 314.12770 187.0
[M+CH3COO]- 328.14335 211.3
[M+Na-2H]- 290.10417 167.6
[M]+ 269.12895 169.0
[M]- 269.13005 169.0
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