CID 54702896

N-allyl-4-hydroxy-1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxamide

Structural Information

Molecular Formula
C14H14N2O3
SMILES
CN1C2=CC=CC=C2C(=C(C1=O)C(=O)NCC=C)O
InChI
InChI=1S/C14H14N2O3/c1-3-8-15-13(18)11-12(17)9-6-4-5-7-10(9)16(2)14(11)19/h3-7,17H,1,8H2,2H3,(H,15,18)
InChIKey
MLFNQOSKGYVRFB-UHFFFAOYSA-N
Compound name
4-hydroxy-1-methyl-2-oxo-N-prop-2-enylquinoline-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

0
Patents

258.10043 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.10771 156.2
[M+Na]+ 281.08965 165.7
[M-H]- 257.09315 158.8
[M+NH4]+ 276.13425 172.4
[M+K]+ 297.06359 161.2
[M+H-H2O]+ 241.09769 149.2
[M+HCOO]- 303.09863 177.3
[M+CH3COO]- 317.11428 197.8
[M+Na-2H]- 279.07510 161.0
[M]+ 258.09988 157.7
[M]- 258.10098 157.7
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

No patent data available for this compound.