CID 10702361

7-methoxy-2-methylquinoline

Structural Information

Molecular Formula
C11H11NO
SMILES
CC1=NC2=C(C=C1)C=CC(=C2)OC
InChI
InChI=1S/C11H11NO/c1-8-3-4-9-5-6-10(13-2)7-11(9)12-8/h3-7H,1-2H3
InChIKey
QEVADHKTNBIYSD-UHFFFAOYSA-N
Compound name
7-methoxy-2-methylquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

102
Patents

173.08406 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.09134 134.5
[M+Na]+ 196.07328 144.4
[M-H]- 172.07678 138.2
[M+NH4]+ 191.11788 155.0
[M+K]+ 212.04722 141.6
[M+H-H2O]+ 156.08132 127.8
[M+HCOO]- 218.08226 157.3
[M+CH3COO]- 232.09791 181.7
[M+Na-2H]- 194.05873 143.6
[M]+ 173.08351 136.6
[M]- 173.08461 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