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]+ 277.227426 170.3
[M+Na]+ 299.209368 175.8
[M-H]- 275.212874 176.5
[M+NH4]+ 294.253973 187.9
[M+K]+ 315.183308 175.2
[M+H-H2O]+ 259.217410 162.8
[M+HCOO]- 321.218351 194.6
[M+CH3COO]- 335.234001 217.1
[M+Na-2H]- 297.194816 169.9
[M]+ 276.21960142 175.3
[M]- 276.22069858 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.