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]+ 330.217606 181.8
[M+Na]+ 352.199548 186.3
[M-H]- 328.203054 185.3
[M+NH4]+ 347.244153 195.5
[M+K]+ 368.173488 183.5
[M+H-H2O]+ 312.207590 172.4
[M+HCOO]- 374.208531 203.7
[M+CH3COO]- 388.224181 220.4
[M+Na-2H]- 350.184996 185.4
[M]+ 329.20978142 186.5
[M]- 329.21087858 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.