CID 53127

74816-32-3

Structural Information

Molecular Formula
C13H19ClN2O
SMILES
CCN(CC)CC(=O)N(C)C1=CC=C(C=C1)Cl
InChI
InChI=1S/C13H19ClN2O/c1-4-16(5-2)10-13(17)15(3)12-8-6-11(14)7-9-12/h6-9H,4-5,10H2,1-3H3
InChIKey
NNFUEAORQJQDAE-UHFFFAOYSA-N
Compound name
N-(4-chlorophenyl)-2-(diethylamino)-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

254.11859 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.12587 159.9
[M+Na]+ 277.10781 166.0
[M-H]- 253.11131 165.9
[M+NH4]+ 272.15241 178.7
[M+K]+ 293.08175 164.2
[M+H-H2O]+ 237.11585 153.4
[M+HCOO]- 299.11679 181.1
[M+CH3COO]- 313.13244 206.3
[M+Na-2H]- 275.09326 162.5
[M]+ 254.11804 164.9
[M]- 254.11914 164.9
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.