CID 258761

6-methoxy-4-methylquinoline

Structural Information

Molecular Formula
C11H11NO
SMILES
CC1=C2C=C(C=CC2=NC=C1)OC
InChI
InChI=1S/C11H11NO/c1-8-5-6-12-11-4-3-9(13-2)7-10(8)11/h3-7H,1-2H3
InChIKey
MBVGYFIYXWVPQY-UHFFFAOYSA-N
Compound name
6-methoxy-4-methylquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

140
Patents

173.08406 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.091336 134.5
[M+Na]+ 196.073278 144.4
[M-H]- 172.076784 138.2
[M+NH4]+ 191.117883 155.0
[M+K]+ 212.047218 141.6
[M+H-H2O]+ 156.081320 127.8
[M+HCOO]- 218.082261 157.3
[M+CH3COO]- 232.097911 181.7
[M+Na-2H]- 194.058726 143.6
[M]+ 173.08351142 136.6
[M]- 173.08460858 136.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe