CID 104590

53725-52-3

Structural Information

Molecular Formula
C21H32N2O
SMILES
CCN(CC)CC(=O)N1C(CC(=CC1(C)C)C2=CC=CC=C2)(C)C
InChI
InChI=1S/C21H32N2O/c1-7-22(8-2)16-19(24)23-20(3,4)14-18(15-21(23,5)6)17-12-10-9-11-13-17/h9-14H,7-8,15-16H2,1-6H3
InChIKey
DTTVBSRGHJKBOQ-UHFFFAOYSA-N
Compound name
2-(diethylamino)-1-(2,2,6,6-tetramethyl-4-phenyl-3H-pyridin-1-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

328.25146 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 329.258736 180.1
[M+Na]+ 351.240678 185.8
[M-H]- 327.244184 186.4
[M+NH4]+ 346.285283 197.5
[M+K]+ 367.214618 183.3
[M+H-H2O]+ 311.248720 172.3
[M+HCOO]- 373.249661 199.0
[M+CH3COO]- 387.265311 218.6
[M+Na-2H]- 349.226126 181.5
[M]+ 328.25091142 181.9
[M]- 328.25200858 181.9
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.