CID 213308

N-(p-chloro-alpha,alpha-dimethylphenethyl)-2-(diethylamino)propionamide hydrochloride

Structural Information

Molecular Formula
C17H27ClN2O
SMILES
CCN(CC)C(C)C(=O)NC(C)(C)CC1=CC=C(C=C1)Cl
InChI
InChI=1S/C17H27ClN2O/c1-6-20(7-2)13(3)16(21)19-17(4,5)12-14-8-10-15(18)11-9-14/h8-11,13H,6-7,12H2,1-5H3,(H,19,21)
InChIKey
OMGSPSUJOGDDDN-UHFFFAOYSA-N
Compound name
N-[1-(4-chlorophenyl)-2-methylpropan-2-yl]-2-(diethylamino)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

310.18118 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.18846 177.6
[M+Na]+ 333.17040 182.1
[M-H]- 309.17390 181.9
[M+NH4]+ 328.21500 193.5
[M+K]+ 349.14434 178.9
[M+H-H2O]+ 293.17844 171.3
[M+HCOO]- 355.17938 194.5
[M+CH3COO]- 369.19503 216.0
[M+Na-2H]- 331.15585 178.5
[M]+ 310.18063 181.7
[M]- 310.18173 181.7
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.