CID 486913

3-(dimethylamino)-4-(m-tolylmethyl)-5,6,7,8-tetrahydro-1h-quinolin-2-one

Structural Information

Molecular Formula
C19H24N2O
SMILES
CC1=CC(=CC=C1)CC2=C(C(=O)NC3=C2CCCC3)N(C)C
InChI
InChI=1S/C19H24N2O/c1-13-7-6-8-14(11-13)12-16-15-9-4-5-10-17(15)20-19(22)18(16)21(2)3/h6-8,11H,4-5,9-10,12H2,1-3H3,(H,20,22)
InChIKey
UDQVBLFLDVCHJR-UHFFFAOYSA-N
Compound name
3-(dimethylamino)-4-[(3-methylphenyl)methyl]-5,6,7,8-tetrahydro-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

296.18887 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.19615 171.4
[M+Na]+ 319.17809 177.9
[M-H]- 295.18159 177.2
[M+NH4]+ 314.22269 186.2
[M+K]+ 335.15203 172.8
[M+H-H2O]+ 279.18613 162.4
[M+HCOO]- 341.18707 189.9
[M+CH3COO]- 355.20272 209.7
[M+Na-2H]- 317.16354 174.3
[M]+ 296.18832 169.5
[M]- 296.18942 169.5
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.