CID 12715494

6-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline

Structural Information

Molecular Formula
C11H15NO
SMILES
CC1CCC2=C(N1)C=CC(=C2)OC
InChI
InChI=1S/C11H15NO/c1-8-3-4-9-7-10(13-2)5-6-11(9)12-8/h5-8,12H,3-4H2,1-2H3
InChIKey
FFNZAVKUPGTJAX-UHFFFAOYSA-N
Compound name
6-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

177.11537 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.12265 138.3
[M+Na]+ 200.10459 145.7
[M-H]- 176.10809 139.9
[M+NH4]+ 195.14919 157.8
[M+K]+ 216.07853 142.5
[M+H-H2O]+ 160.11263 132.0
[M+HCOO]- 222.11357 156.7
[M+CH3COO]- 236.12922 179.7
[M+Na-2H]- 198.09004 144.9
[M]+ 177.11482 135.7
[M]- 177.11592 135.7
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