CID 209286

19655-39-1

Structural Information

Molecular Formula
C20H27N3O2
SMILES
CCCCOC1=C2C(=C(C=C1)NC(=O)CN3CCCCC3)C=CC=N2
InChI
InChI=1S/C20H27N3O2/c1-2-3-14-25-18-10-9-17(16-8-7-11-21-20(16)18)22-19(24)15-23-12-5-4-6-13-23/h7-11H,2-6,12-15H2,1H3,(H,22,24)
InChIKey
BPWVZCGHAURXML-UHFFFAOYSA-N
Compound name
N-(8-butoxyquinolin-5-yl)-2-piperidin-1-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.21033 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.217606 183.6
[M+Na]+ 364.199548 186.5
[M-H]- 340.203054 186.5
[M+NH4]+ 359.244153 194.2
[M+K]+ 380.173488 181.7
[M+H-H2O]+ 324.207590 172.6
[M+HCOO]- 386.208531 199.2
[M+CH3COO]- 400.224181 214.7
[M+Na-2H]- 362.184996 186.6
[M]+ 341.20978142 181.5
[M]- 341.21087858 181.5
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.