CID 209278

Acetamide, n-(8-butoxy-5-quinolyl)-2-(diethylamino)-, dihydrochloride

Structural Information

Molecular Formula
C19H27N3O2
SMILES
CCCCOC1=C2C(=C(C=C1)NC(=O)CN(CC)CC)C=CC=N2
InChI
InChI=1S/C19H27N3O2/c1-4-7-13-24-17-11-10-16(15-9-8-12-20-19(15)17)21-18(23)14-22(5-2)6-3/h8-12H,4-7,13-14H2,1-3H3,(H,21,23)
InChIKey
VGJKXNJOQQYBDU-UHFFFAOYSA-N
Compound name
N-(8-butoxyquinolin-5-yl)-2-(diethylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.21033 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.21761 181.8
[M+Na]+ 352.19955 186.3
[M-H]- 328.20305 185.3
[M+NH4]+ 347.24415 195.5
[M+K]+ 368.17349 183.5
[M+H-H2O]+ 312.20759 172.4
[M+HCOO]- 374.20853 203.7
[M+CH3COO]- 388.22418 220.4
[M+Na-2H]- 350.18500 185.4
[M]+ 329.20978 186.5
[M]- 329.21088 186.5
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.