CID 208568

32421-48-0

Structural Information

Molecular Formula
C16H21N3O
SMILES
CCN(CC)CCNC(=O)C1=NC2=CC=CC=C2C=C1
InChI
InChI=1S/C16H21N3O/c1-3-19(4-2)12-11-17-16(20)15-10-9-13-7-5-6-8-14(13)18-15/h5-10H,3-4,11-12H2,1-2H3,(H,17,20)
InChIKey
LNVXBKJDZSJYQZ-UHFFFAOYSA-N
Compound name
N-[2-(diethylamino)ethyl]quinoline-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

271.16846 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.17574 164.8
[M+Na]+ 294.15768 169.9
[M-H]- 270.16118 168.6
[M+NH4]+ 289.20228 180.7
[M+K]+ 310.13162 167.1
[M+H-H2O]+ 254.16572 156.0
[M+HCOO]- 316.16666 187.6
[M+CH3COO]- 330.18231 208.2
[M+Na-2H]- 292.14313 170.8
[M]+ 271.16791 166.7
[M]- 271.16901 166.7
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