CID 200202

Acetamide, 2-(diethylamino)-n-(5-isopropyl-2-methylbenzyl)-n-methyl-, monohydrochloride

Structural Information

Molecular Formula
C18H30N2O
SMILES
CCN(CC)CC(=O)N(C)CC1=C(C=CC(=C1)C(C)C)C
InChI
InChI=1S/C18H30N2O/c1-7-20(8-2)13-18(21)19(6)12-17-11-16(14(3)4)10-9-15(17)5/h9-11,14H,7-8,12-13H2,1-6H3
InChIKey
AKSXLRKPGVJRIX-UHFFFAOYSA-N
Compound name
2-(diethylamino)-N-methyl-N-[(2-methyl-5-propan-2-ylphenyl)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]+ 291.24308 175.8
[M+Na]+ 313.22502 179.6
[M-H]- 289.22852 181.5
[M+NH4]+ 308.26962 192.4
[M+K]+ 329.19896 179.3
[M+H-H2O]+ 273.23306 167.9
[M+HCOO]- 335.23400 198.8
[M+CH3COO]- 349.24965 219.7
[M+Na-2H]- 311.21047 174.3
[M]+ 290.23525 180.2
[M]- 290.23635 180.2
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

No patent data available for this compound.