CID 120491

2-(diethylamino)-n-methyl-n-(2,4,6-trimethylbenzyl)acetamide hydrochloride

Structural Information

Molecular Formula
C17H28N2O
SMILES
CCN(CC)CC(=O)N(C)CC1=C(C=C(C=C1C)C)C
InChI
InChI=1S/C17H28N2O/c1-7-19(8-2)12-17(20)18(6)11-16-14(4)9-13(3)10-15(16)5/h9-10H,7-8,11-12H2,1-6H3
InChIKey
KQBGUJQOZMWXAW-UHFFFAOYSA-N
Compound name
2-(diethylamino)-N-methyl-N-[(2,4,6-trimethylphenyl)methyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.22015 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.22743 170.3
[M+Na]+ 299.20937 175.8
[M-H]- 275.21287 176.5
[M+NH4]+ 294.25397 187.9
[M+K]+ 315.18331 175.2
[M+H-H2O]+ 259.21741 162.8
[M+HCOO]- 321.21835 194.6
[M+CH3COO]- 335.23400 217.1
[M+Na-2H]- 297.19482 169.9
[M]+ 276.21960 175.3
[M]- 276.22070 175.3
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.