CID 17750643

927800-85-9

Structural Information

Molecular Formula
C13H15NO2
SMILES
CCCC1=CC(=O)C2=C(N1)C=CC(=C2)OC
InChI
InChI=1S/C13H15NO2/c1-3-4-9-7-13(15)11-8-10(16-2)5-6-12(11)14-9/h5-8H,3-4H2,1-2H3,(H,14,15)
InChIKey
SILBPTYHCIOZFB-UHFFFAOYSA-N
Compound name
6-methoxy-2-propyl-1H-quinolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.11028 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.11756 146.7
[M+Na]+ 240.09950 156.5
[M-H]- 216.10300 149.1
[M+NH4]+ 235.14410 165.0
[M+K]+ 256.07344 152.2
[M+H-H2O]+ 200.10754 140.0
[M+HCOO]- 262.10848 167.6
[M+CH3COO]- 276.12413 187.6
[M+Na-2H]- 238.08495 153.5
[M]+ 217.10973 148.8
[M]- 217.11083 148.8
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.