CID 3062448

98110-07-7

Structural Information

Molecular Formula
C15H24N2O
SMILES
CCN(CC)C(=O)C(C)NC1=C(C=CC=C1C)C
InChI
InChI=1S/C15H24N2O/c1-6-17(7-2)15(18)13(5)16-14-11(3)9-8-10-12(14)4/h8-10,13,16H,6-7H2,1-5H3
InChIKey
QXNKYWCPPNORLU-UHFFFAOYSA-N
Compound name
2-(2,6-dimethylanilino)-N,N-diethylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

248.18886 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.196136 162.2
[M+Na]+ 271.178078 167.2
[M-H]- 247.181584 167.0
[M+NH4]+ 266.222683 179.9
[M+K]+ 287.152018 166.1
[M+H-H2O]+ 231.186120 155.0
[M+HCOO]- 293.187061 185.7
[M+CH3COO]- 307.202711 207.3
[M+Na-2H]- 269.163526 163.0
[M]+ 248.18831142 164.2
[M]- 248.18940858 164.2
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