CID 120496

Acetamide, 2-(diethylamino)-n-ethyl-n-(2,4,6-trimethylbenzyl)-, hydrochloride

Structural Information

Molecular Formula
C18H30N2O
SMILES
CCN(CC)CC(=O)N(CC)CC1=C(C=C(C=C1C)C)C
InChI
InChI=1S/C18H30N2O/c1-7-19(8-2)13-18(21)20(9-3)12-17-15(5)10-14(4)11-16(17)6/h10-11H,7-9,12-13H2,1-6H3
InChIKey
LVMHOVOQRPSCDY-UHFFFAOYSA-N
Compound name
2-(diethylamino)-N-ethyl-N-[(2,4,6-trimethylphenyl)methyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.2358 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.243076 175.0
[M+Na]+ 313.225018 180.1
[M-H]- 289.228524 181.0
[M+NH4]+ 308.269623 192.1
[M+K]+ 329.198958 179.2
[M+H-H2O]+ 273.233060 167.3
[M+HCOO]- 335.234001 199.0
[M+CH3COO]- 349.249651 220.1
[M+Na-2H]- 311.210466 174.1
[M]+ 290.23525142 180.4
[M]- 290.23634858 180.4
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.