CID 2825196

7-acetamido-1-ethyl-1,2,3,4-tetrahydro-2,2,4-trimethylquinoline

Structural Information

Molecular Formula
C16H24N2O
SMILES
CCN1C2=C(C=CC(=C2)NC(=O)C)C(CC1(C)C)C
InChI
InChI=1S/C16H24N2O/c1-6-18-15-9-13(17-12(3)19)7-8-14(15)11(2)10-16(18,4)5/h7-9,11H,6,10H2,1-5H3,(H,17,19)
InChIKey
SXPXTTKGVYQPAM-UHFFFAOYSA-N
Compound name
N-(1-ethyl-2,2,4-trimethyl-3,4-dihydroquinolin-7-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

260.18887 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.196146 162.2
[M+Na]+ 283.178088 170.0
[M-H]- 259.181594 165.4
[M+NH4]+ 278.222693 181.3
[M+K]+ 299.152028 166.6
[M+H-H2O]+ 243.186130 155.7
[M+HCOO]- 305.187071 180.5
[M+CH3COO]- 319.202721 203.7
[M+Na-2H]- 281.163536 165.5
[M]+ 260.18832142 162.2
[M]- 260.18941858 162.2
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

patents stripe