CID 44630253

6,8-dimethoxy-4-methylquinoline

Structural Information

Molecular Formula
C12H13NO2
SMILES
CC1=C2C=C(C=C(C2=NC=C1)OC)OC
InChI
InChI=1S/C12H13NO2/c1-8-4-5-13-12-10(8)6-9(14-2)7-11(12)15-3/h4-7H,1-3H3
InChIKey
DZXKOXPAULZIGL-UHFFFAOYSA-N
Compound name
6,8-dimethoxy-4-methylquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

203.09464 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.10192 142.3
[M+Na]+ 226.08386 152.7
[M-H]- 202.08736 146.3
[M+NH4]+ 221.12846 161.9
[M+K]+ 242.05780 150.2
[M+H-H2O]+ 186.09190 135.5
[M+HCOO]- 248.09284 165.0
[M+CH3COO]- 262.10849 187.9
[M+Na-2H]- 224.06931 150.2
[M]+ 203.09409 146.7
[M]- 203.09519 146.7
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