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]+ 329.25874 180.1
[M+Na]+ 351.24068 185.8
[M-H]- 327.24418 186.4
[M+NH4]+ 346.28528 197.5
[M+K]+ 367.21462 183.3
[M+H-H2O]+ 311.24872 172.3
[M+HCOO]- 373.24966 199.0
[M+CH3COO]- 387.26531 218.6
[M+Na-2H]- 349.22613 181.5
[M]+ 328.25091 181.9
[M]- 328.25201 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.