CID 49952

67625-02-9

Structural Information

Molecular Formula
C14H21Cl2N3O
SMILES
CCN(CC)CC(=O)NC1=C(C=C(C=C1Cl)N(C)C)Cl
InChI
InChI=1S/C14H21Cl2N3O/c1-5-19(6-2)9-13(20)17-14-11(15)7-10(18(3)4)8-12(14)16/h7-8H,5-6,9H2,1-4H3,(H,17,20)
InChIKey
KIILJUZJPQFLCD-UHFFFAOYSA-N
Compound name
N-[2,6-dichloro-4-(dimethylamino)phenyl]-2-(diethylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

317.10617 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 318.11345 175.9
[M+Na]+ 340.09539 182.9
[M-H]- 316.09889 181.5
[M+NH4]+ 335.13999 192.7
[M+K]+ 356.06933 179.4
[M+H-H2O]+ 300.10343 170.1
[M+HCOO]- 362.10437 192.6
[M+CH3COO]- 376.12002 220.7
[M+Na-2H]- 338.08084 175.9
[M]+ 317.10562 182.3
[M]- 317.10672 182.3
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.